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a356926674金虫 (小有名气)
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[求助]
求助一微谱数据 已有1人参与
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| C谱(DMSO): 40.00, 100.27, 102.17, 105.32, 122.80, 122.97, 123.96, 126.64, 127.96,129.43, 129.49, 143.67, 148.05, 151.41, 151.76 |
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木虫 (正式写手)
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a356926674: 金币+10, ★★★★★最佳答案 2014-11-12 15:08:32
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a356926674: 金币+10, ★★★★★最佳答案 2014-11-12 15:08:32
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查询结果:共查到3411个化合物(查询结果仅供参考) 1 . asiaticumine A C16H13NO4 相似度:75% Chemistry & Biodiversity 2009 6 1751-1757 Chemical Constituents of Crinum asiaticum L. var. sinicum Baker and Their Cytotoxic Activities Qian Sun, Yun-Heng Shen, Jun-Mian Tian, Jian Tang, Juan Su, Run-Hui Liu, Hui-Liang Li, Xi-Ke Xu, and Wei-Dong Zhang Structure 13C NMR 碳谱模拟图 2 . 4-(1H-Benzimidazol-2-ylamino)-3-nitro-2H-chromen-2-one C16H10N4O4 相似度:73.3% Molecules 2010 15 2246-2256 Synthesis and Antimicrobial Activity of New 4-Heteroarylamino Coumarin Derivatives Containing Nitrogen and Sulfur as Heteroatoms Biljana R. Dekić, Niko S. Radulović, Vidoslav S. Dekić, Rastko D. Vukićević and Radosav M. Palić Structure 13C NMR 碳谱模拟图 3 . 5-nitro-4-(3-nitrophenyl)-6-phenyl-3,4-dihydropyrimidin-2(1H)-one 相似度:73.3% Russian Journal of Organic Chemistry 2007 43 90-95 Synthesis of 5-nitro-3,4-dihydropyrimidin-2(1H)-ones catalyzed by metal salts. Retro-Henry reaction with formation of N,N′-disubstituted ureas V. F. Sedova, V. P. Krivopalov and O. P. Shkurko Structure 13C NMR 碳谱模拟图 4 . 7-Benzyl-4-(4-aminophenoxy)-7H-pyrrolo[2,3-d]pyrimidine C19H16N4O 相似度:73.3% Bioorganic & Medicinal Chemistry 2012 20 5473-5482 Identification and synthesis of substituted pyrrolo[2,3-d]pyrimidines as novel firefly luciferase inhibitors Yang Liu, Jianping Fang, Haiyan Cai, Fei Xiao, Kan Ding, Youhong Hu Structure 13C NMR 碳谱模拟图 5 . (E)-N'-((E)-3-(4-nitrophenyl)allylidene)-2,3-dihydrobenzo[1,4]dioxine-6-carbohydrazide C18H15N3O5 相似度:73.3% Chemical & Pharmaceutical Bulletin 2014 62 1110-1118 Synthesis and Antibacterial Activity of Cinnamaldehyde Acylhydrazone with a 1,4-Benzodioxan Fragment as a Novel Class of Potent β-Ketoacyl–Acyl Carrier Protein Synthase III (FabH) Inhibitor Xiaoda Song, Yushun Yang, Jing Zhao, Yangjian Chen Structure 13C NMR 碳谱模拟图 6 . 4-[3-(4-Methylphenyl)-5-trifluoromethyl-1H-pyrazol-1-yl]-7- chloroquinoline C20H13ClF3N3 相似度:72.2% Journal of Heterocyclic Chemistry 2005 42 1055-1061 An efficient and regiospecific preparation of trifluoromethyl substituted 4-( 1H-pyrazol-1-yl)-7-chloroquinolines Helio G. Bonacorso,Cleber A. Cechinel,Marli R. Oliveira,Michelle B. Costa,Marcos A. P. Martins,Nilo Zanatta and Alex F. C. Flores Structure 13C NMR 碳谱模拟图 7 . N-[4-(Benzo[f]quinazolin-6'-ylamino)phenyl]methanesulfonamide C19H16N4O2S 相似度:70.5% Bioorganic & Medicinal Chemistry 2011 19 1197-1204 Benzoquinazoline derivatives as new agents affecting DNA processing Giovanni Marzaro, Lisa Dalla Via, Antonio Toninello, Adriano Guiotto, Adriana Chilin Structure 13C NMR 碳谱模拟图 8 . 4-[3-(4-Fluorophenyl)-5-trifluoromethyl-1H-pyrazol-1-yl]-7- chloroquinoline C19H10ClF4N3 相似度:70.5% Journal of Heterocyclic Chemistry 2005 42 1055-1061 An efficient and regiospecific preparation of trifluoromethyl substituted 4-( 1H-pyrazol-1-yl)-7-chloroquinolines Helio G. Bonacorso,Cleber A. Cechinel,Marli R. Oliveira,Michelle B. Costa,Marcos A. P. Martins,Nilo Zanatta and Alex F. C. Flores Structure 13C NMR 碳谱模拟图 9 . 4-[3-(4-Chlorophenyl)-5-trifluoromethyl-1H-pyrazol-1-yl]-7- chloroquinoline C19H10Cl2F3N3 相似度:70.5% Journal of Heterocyclic Chemistry 2005 42 1055-1061 An efficient and regiospecific preparation of trifluoromethyl substituted 4-( 1H-pyrazol-1-yl)-7-chloroquinolines Helio G. Bonacorso,Cleber A. Cechinel,Marli R. Oliveira,Michelle B. Costa,Marcos A. P. Martins,Nilo Zanatta and Alex F. C. Flores Structure 13C NMR 碳谱模拟图 10 . 4-[3-(4-Bromophenyl)-5-trifluoromethyl-1H-pyrazol-1-yl]-7- chloroquinoline C19H10BrClF3N3 相似度:70.5% Journal of Heterocyclic Chemistry 2005 42 1055-1061 An efficient and regiospecific preparation of trifluoromethyl substituted 4-( 1H-pyrazol-1-yl)-7-chloroquinolines Helio G. Bonacorso,Cleber A. Cechinel,Marli R. Oliveira,Michelle B. Costa,Marcos A. P. Martins,Nilo Zanatta and Alex F. C. Flores Structure 13C NMR 碳谱模拟图 11 . zanthoxyline 相似度:68.7% Heterocycles 2010 80 873-877 Synthesis of Zanthoxyline and Its Related Compounds: Revision of the Reported Structure Hitoshi Abe, Naoko Kobayashi, Yasuo Takeuchi, and Takashi Harayama Structure 13C NMR 碳谱模拟图 12 . compound 6 相似度:68.7% Heterocycles 2010 80 873-877 Synthesis of Zanthoxyline and Its Related Compounds: Revision of the Reported Structure Hitoshi Abe, Naoko Kobayashi, Yasuo Takeuchi, and Takashi Harayama Structure 13C NMR 碳谱模拟图 13 . liriodenine 相似度:68.7% Journal of Shenyang Pharmaceutical University 2009 26 104-107 Isolation and identification of chemical constituents from stems of M iliusa balansae Fin. etGag. LEI Yu, WU Li-jun, BI Dan, SUN Jing-wei, TU Peng-fei Structure 13C NMR 碳谱模拟图 14 . (2E)-2-cyano-3-(2-phenyl-1H-indol-3-yl)acrylamide 相似度:68.7% Tetrahedron 2013 69 10858-10868 Unconventional stereoselective one-pot synthesis of Knoevenagel-type indoles via in situ condensation of iminium salts with active methylene reagents Angelo Ranise, Francesco Lucchesini, Matteo Caviglia, Silvana Alfei, Andrea Spallarossa, Chiara Caneva Structure 13C NMR 碳谱模拟图 15 . (2E)-2-(methylsulfonyl)-3-(2-phenyl-1H-indol-3-yl)acrylonitrile C18H14N2O2S 相似度:68.7% Tetrahedron 2013 69 10858-10868 Unconventional stereoselective one-pot synthesis of Knoevenagel-type indoles via in situ condensation of iminium salts with active methylene reagents Angelo Ranise, Francesco Lucchesini, Matteo Caviglia, Silvana Alfei, Andrea Spallarossa, Chiara Caneva Structure 13C NMR 碳谱模拟图 16 . anthracen-9-ylmethyl-benzothiazol-6-yl-amine C22H16N2S 相似度:68.7% Molecules 2014 19 925-939 Synthesis and Broad-Spectrum Antiviral Activity of Some Novel Benzo-Heterocyclic Amine Compounds Da-Jun Zhang, Wen-Fang Sun, Zhao-Jin Zhong, Rong-Mei Gao, Hong Yi, Yu-Huan Li, Zong-Gen Peng and Zhuo-Rong Li Structure 13C NMR 碳谱模拟图 17 . 4-(4-Nitrophenoxy)-7-(4-(trifluoromethyl)benzyl)-7Hpyrrolo[2,3-d]pyrimidine C20H15F3N4O 相似度:68.7% Bioorganic & Medicinal Chemistry 2012 20 5473-5482 Identification and synthesis of substituted pyrrolo[2,3-d]pyrimidines as novel firefly luciferase inhibitors Yang Liu, Jianping Fang, Haiyan Cai, Fei Xiao, Kan Ding, Youhong Hu Structure 13C NMR 碳谱模拟图 18 . (E)-N'-((E)-3-(2-nitrophenyl)allylidene)-2,3-dihydrobenzo[1,4]dioxine-6-carbohydrazide C18H15N3O5 相似度:68.7% Chemical & Pharmaceutical Bulletin 2014 62 1110-1118 Synthesis and Antibacterial Activity of Cinnamaldehyde Acylhydrazone with a 1,4-Benzodioxan Fragment as a Novel Class of Potent β-Ketoacyl–Acyl Carrier Protein Synthase III (FabH) Inhibitor Xiaoda Song, Yushun Yang, Jing Zhao, Yangjian Chen Structure 13C NMR 碳谱模拟图 19 . N-[4-(Benzo[h]quinazolin-6'-ylamino)-3-methoxyphenyl]methanesulfonamide C20H18N4O3S 相似度:68.4% Bioorganic & Medicinal Chemistry 2011 19 1197-1204 Benzoquinazoline derivatives as new agents affecting DNA processing Giovanni Marzaro, Lisa Dalla Via, Antonio Toninello, Adriano Guiotto, Adriana Chilin Structure 13C NMR 碳谱模拟图 20 . 8,8''-bibaicalein C30H18O10 相似度:66.6% Chemistry of Natural Compounds 2002 38 473-519 PHENOLIC COMPOUNDS OF PLANTS OF THE Scutellaria GENUS. DISTRIBUTION, STRUCTURE, AND PROPERTIES V. M. Malikov and M. P. Yuldashev Structure 13C NMR 碳谱模拟图 21 . 1H-pyrrolo[2,3-a]-phenanthridine 相似度:66.6% Chemistry of Natural Compounds 1991 27 352-358 INVESTIGATION OF THE STRUCTURE AND COMPLEX-FORMATION OF ISOMERIC PYRROLOPHENANTHRIDINES AND THEIR QUATERNARY SALTS BY IH AND l3C NMR SPECTROSCOPIES L. N. Kurkovskaya, I. A. Bezrukov, S. N. Krasnokutskii,E. P. Baberkina, M. E. Samoilova, and N. N. Suvorov Structure 13C NMR 碳谱模拟图 22 . platanin 相似度:66.6% Journal of Natural Products 1988 Vol 51 353 Novel Methylated Flavonols with Unsubstituted B Ring from Platanus acerifolia Buds Mourad Kaouadji, Patrick Ravanel, Michel Tissut, Sophie Creuzet Structure 13C NMR 碳谱模拟图 23 . Quinolin-2-yl-(4-trifluoromethyl-phenyl)-amine C16H11F3N2 相似度:66.6% Bioorganic & Medicinal Chemistry 2011 19 939-950 Microwave-assisted synthesis of quinoline, isoquinoline, quinoxaline and quinazoline derivatives as CB2 receptor agonists Raimo Saari, Jonna-Carita Törmä, Tapio Nevalainen Structure 13C NMR 碳谱模拟图 24 . 6-[N-(Dimethylamino)ethyl]aminobenzo[f]quinazoline C16H18N4 相似度:66.6% Bioorganic & Medicinal Chemistry 2011 19 1197-1204 Benzoquinazoline derivatives as new agents affecting DNA processing Giovanni Marzaro, Lisa Dalla Via, Antonio Toninello, Adriano Guiotto, Adriana Chilin Structure 13C NMR 碳谱模拟图 25 . Compound 58 相似度:66.6% Bioorganic & Medicinal Chemistry 2012 20 1029-1045 Cyclohexane 1,3-diones and their inhibition of mutant SOD1-dependent protein aggregation and toxicity in PC12 cells Wei Zhang,Radhia Benmohamed,Anthony C. Arvanites, Richard I. Morimoto, Robert J. Ferrante,Donald R. Kirsch, Richard B. Silverman Structure 13C NMR 碳谱模拟图 26 . 4',6-dihydroxy-7,8-dimethylisoflavone C17H14O4 相似度:66.6% Chemical & Pharmaceutical Bulletin 2009 57 346-360 Synthesis of Various Kinds of Isoflavones, Isoflavanes, and Biphenyl-Ketones and Their 1,1-Diphenyl-2-picrylhydrazyl Radical-Scavenging Activities Hideyuki Goto, Yoshiyasu Terao and Shuji Akai Structure 13C NMR 碳谱模拟图 27 . 5-benzofuran-2-yl-2-cyanopyrazolo[1,5-a]pyrimidine C15H8N4O 相似度:66.6% Journal of Heterocyclic Chemistry 2009 46 680-686 Convenient synthesis of some new pyrazolo[1,5-a]pyrimidine,pyridine,thieno[2,3-b]pyridine,and isoxazolo[3,4-d]pyridazine derivatives containing benzofuran moiety Abdou O. Abdelhamid Structure 13C NMR 碳谱模拟图 28 . 4-chloro-8-tosyloxyquinoline C16H11NO3SCl 相似度:66.6% Journal of Heterocyclic Chemistry 2008 45 593-595 Synthesis of 8-hydroxyquinolines with amino and thioalkyl functionalities at position 4 Walaa A. E. Omar,Juha P. Heiskanen and Osmo E. O. Hormi Structure 13C NMR 碳谱模拟图 29 . 4-(3-pyridyl)quinoline-2-carboxylic acid C15H11N2O2 相似度:66.6% Journal of Heterocyclic Chemistry 2008 45 1377-1384 Optimized palladium-based approaches to analogues of PK 11195 Sandrine Guillou and Yves L. Janin Structure 13C NMR 碳谱模拟图 30 . 1,2-dihydro-1-phenyl-[1,3]oxazino[5,6-f]quinolin-3-one C17H12N2O2 相似度:66.6% Journal of Heterocyclic Chemistry 2008 45 1481-1484 A three-component,one-pot synthesis of oxazinoquinolin-3-one derivatives Gazaleh Imani Shakibaei,Hamid Reza Khavasi,Peiman Mirzaei and Ayoob Bazgir Structure 13C NMR 碳谱模拟图 31 . (E)-2-(2-(pyridin-4-yl)vinyl)quinazolin-4(3H)-one C15H11N3O 相似度:66.6% Journal of Heterocyclic Chemistry 2006 43 1057-1063 Convenient synthesis of some 2-substituted 4(3H)-quinazolinone derivatives I. Philipova,G. Dobrikov,K. Krumova and J. Kaneti Structure 13C NMR 碳谱模拟图 32 . 5-(1,5-diphenyl-1H-pyrazol-3-yl)-4H-1,2,4-triazole-3-thiole C17H13N5S 相似度:66.6% Journal of Heterocyclic Chemistry 2006 43 1183-1188 Convenient synthesis of some new substituted pyrazolyl-1,3,4-oxadiazoles and pyrazolyl-1,2,4-triazoles Yehya M. Elkholy,Korany A. Ali and Ahmad M. Farag Structure 13C NMR 碳谱模拟图 33 . (2Z)-3-(2-phenylimidazol-4-yl)-2-pyridin-2-ylpropennitrile C17H12N4 相似度:66.6% Journal of Heterocyclic Chemistry 2006 43 1583-1589 Synthesis and e/z determination of substituted 2-phenylimidazoles ToméŠ Szotkowski,Filip Bureš,Oldǐich Pytela,Jiǐí Kulhének and Zdeněk Trévníček Structure 13C NMR 碳谱模拟图 34 . (5-hydroxynaphtho[1,2-b]furan-3-yl)-phenylmethanone C19H12O3 相似度:66.6% Journal of Heterocyclic Chemistry 2005 42 563-566 Enaminones in heterocyclic synthesis: Synthesis and chemical reactivity of 3-anilino-1-substituted-2-propene-1-one Balkis Al-Saleh,Morsy Ahmed El-Apasery,Rasha Safwat Abdel-Aziz and Mohamed Hilmy Elnagdi Structure 13C NMR 碳谱模拟图 35 . 4-(4'-Dimethylaminostyryl)phthalhydrazide C18H17N3O2 相似度:66.6% Journal of Heterocyclic Chemistry 2005 42 1063-1068 Synthesis of 4-styrylphthalhydrazides and their chemiluminescence reaction. Emitters and chemiluminescence efficiency highly dependent on electronic nature of styryl goups Jiro Motoyoshiya,Kazuya Yokota,Takuro Fukami,Shoji Konno,Aya Yamamoto,Masanori Hotta,Ryu Koike,Sachiko Yoshioka,Yoshinori Nishi and Hiromu Aoyama Structure 13C NMR 碳谱模拟图 36 . 4-[3-(4-Methoxyphenyl)-5-trifluoromethyl-1H-pyrazol-1-yl]-7- chloroquinoline C20H13ClF3N3O 相似度:66.6% Journal of Heterocyclic Chemistry 2005 42 1055-1061 An efficient and regiospecific preparation of trifluoromethyl substituted 4-( 1H-pyrazol-1-yl)-7-chloroquinolines Helio G. Bonacorso,Cleber A. Cechinel,Marli R. Oliveira,Michelle B. Costa,Marcos A. P. Martins,Nilo Zanatta and Alex F. C. Flores Structure 13C NMR 碳谱模拟图 37 . 2-(2,4-dichlorophenylcarbamoyl)amino-2-(4-nitrophenyl)-propanoicacid C16H13Cl2N3O5 相似度:66.6% Journal of Heterocyclic Chemistry 2005 42 899-906 Multinuclear NMR studies and ab initio structure calculations of hindered phencyclone diels-alder adducts from symmetrical cyclic dienophiles: Cyclohexene,vinylene carbonate,vinylene trithiocarbonate and two N-aryl maleimides Ronald Callahan,Orlando Ramirez III,Kerstin Rosmarion,Robert Rothchild and Kevin C. Bynum Structure 13C NMR 碳谱模拟图 38 . compound 4c C21H12Cl5N2O8P 相似度:66.6% Journal of Heterocyclic Chemistry 2003 40 345-351 Facile syntheses and antimicrobial studies of 6-(aryloxy/arylthio/chloroethoxy)-2,10-dichloro-4,8-dinitro-12-trichloromemyl-12H-dibenzo[d,g][13,2]dioxaphosphocin 6-oxides K. Ananda Kumar,M. Kasthuraiah,C. Suresh Reddy and K. D. Berlin Structure 13C NMR 碳谱模拟图 39 . compound 4d C21H12Cl5N2O8P 相似度:66.6% Journal of Heterocyclic Chemistry 2003 40 345-351 Facile syntheses and antimicrobial studies of 6-(aryloxy/arylthio/chloroethoxy)-2,10-dichloro-4,8-dinitro-12-trichloromemyl-12H-dibenzo[d,g][13,2]dioxaphosphocin 6-oxides K. Ananda Kumar,M. Kasthuraiah,C. Suresh Reddy and K. D. Berlin Structure 13C NMR 碳谱模拟图 40 . 2,4-diamino-7,8-dihydro-6-(4-nitrophenyl)-8-phenyl-9H-pyrimido[4,5-b][1,4]diazepine C19H17N7O2 相似度:66.6% Journal of Heterocyclic Chemistry 2000 37 193-194 The reaction of 2,4,5,6-tetraaminopyrimidine with chalcones Braulio Insuasty, Alfredo Pérez, Diego González, Jairo Quiroga and Herbert Meier Structure 13C NMR 碳谱模拟图 41 . 2,4-diamino-6-(4-bromophenyl)-7,8-dihydro-8-phenyl-9H-pyrimido[4,5-b][1,4]diazepine C19H17BrN6 相似度:66.6% Journal of Heterocyclic Chemistry 2000 37 193-194 The reaction of 2,4,5,6-tetraaminopyrimidine with chalcones Braulio Insuasty, Alfredo Pérez, Diego González, Jairo Quiroga and Herbert Meier Structure 13C NMR 碳谱模拟图 42 . compound 5d C18H12NO2Br 相似度:66.6% Heterocycles 2007 71 543-548 A Simple and Environmentally Benign Method for the Synthesis of Naphthoxazin-3-one Derivatives Minoo Dabiri, Akram Sadat Delbari, and Ayoob Bazgir Structure 13C NMR 碳谱模拟图 43 . 3-amino-10-(4-chlorophenyl)-4-imino-3,10-dihydro-4H-9-oxa-1,3-diazaanthracen-7-ol C17H13N4O2Cl 相似度:66.6% Heterocycles 2004 63 1793-1812 Synthesis of Hydroxyquinoline Derivatives, Aminohydroxychromene, Aminocoumarin and Their Antibacterial Activities Alaa S. Abd-El-Aziz,* Ahmed M. El-Agrody, Ahmed H. Bedair, T. Christopher Corkery, and Athar Ata Structure 13C NMR 碳谱模拟图 44 . Compound 11e C18H13ClN2O 相似度:66.6% Bioorganic & Medicinal Chemistry Letters 2010 20 6915-6919 Discovery and selectivity-profiling of 4-benzylamino 1-aza-9-oxafluorene derivatives as lead structures for IGF-1R inhibitors Martin Krug, German Erlenkamp, Wolfgang Sippl, Christoph Schächtele, Frank Totzke, Andreas Hilgeroth Structure 13C NMR 碳谱模拟图 45 . 2-(Benzimidazo-2-yl)-3-phenyl-6-nitroquinoxaline 相似度:66.6% Tetrahedron Letters 2004 45 4003-4007 Application of quantum chemical calculations of 13C NMR chemical shifts to quinoxaline structure determination Alsu Balandina, Vakhid Mamedov, Xavier Franck, Bruno Figadère, Shamil Latypov Structure 13C NMR 碳谱模拟图 46 . 2-Triazol-1-yl-N-[3-(N-methylanilinyl-1-sulfonyl)phenyl]acetamide 相似度:66.6% Archiv der Pharmazie 2008 341 99-112 Synthesis and Anticandidal Activity of Azole-Containing Sulfonamides Amjad M. Qandil, Mohammad A. Hassan and Nizar A. Al-Shar'i Structure 13C NMR 碳谱模拟图 47 . N-(2-(4-Phenylfurazan-3-yloxy)ethyl)nicotinamide C16H14N4O3 相似度:66.6% Bioorganic & Medicinal Chemistry 2000 8 1727-1732 Nicorandil analogues containing NO-donor furoxans and related furazans Donatella Boschi, Clara Cena, Antonella Di Stilo, Roberta Fruttero, Alberto Gasco Structure 13C NMR 碳谱模拟图 48 . Ethyl-6-amino-3-(naphthalen-1-ylamino)-5-oxo-1,2,4-triazin-2(5H)-carboxylat C16H15N5O3 相似度:66.6% Zeitschrift für Naturforschung B 2010 65 571-577 Synthesis and Properties of 3,6-Diamino-substituted 1,2,4-Triazin-5(2H)-ones (In German) D. Geffken and M. A. Köllner Structure 13C NMR 碳谱模拟图 49 . compound 5 C15H11N3O4 相似度:66.6% Heterocycles 2003 61 147-162 Synthesis of Indolo[1,2-b]indazole Derivatives Yong-ming Zhu, Kimiyoshi Kaneko, Osamu Kato, Yoshimitsu Kiryu, Noriyuki Takatsu, Kazuhiko Shiono, and Hajime Katayama* Structure 13C NMR 碳谱模拟图 50 . 4-(9-anthracenyl-10-(2,3-dmaA))-2,2'-bipyridine C29H22N2O2 相似度:66.6% molecules 2011 16 4615-4631 A High Molar Extinction Coefficient Mono-Anthracenyl Bipyridyl Heteroleptic Ruthenium(II) Complex: Synthesis, Photophysical and Electrochemical Properties Adewale O. Adeloye and Peter A. Ajibade Structure 13C NMR 碳谱模拟图 |
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