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2-Cyano-N-[5-(2-methyl-1H-indole-3-carbonyl)-2-phenyl-2H-1,2,3-triazol-4-yl]acetamide
SpectraBase Compound ID FKPLPtMShP6
InChI InChI=1S/C21H16N6O2/c1-13-18(15-9-5-6-10-16(15)23-13)20(29)19-21(24-17(28)11-12-22)26-27(25-19)14-7-3-2-4-8-14/h2-10,23H,11H2,1H3,(H,24,26,28)
InChIKey HBIPBTDYBOTCKH-UHFFFAOYSA-N
Mol Weight 384.4 g/mol
Molecular Formula C21H16N6O2
Exact Mass 384.133474 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FbHeoL4OEEq
Name 2-Cyano-N-[5-(2-methyl-1H-indole-3-carbonyl)-2-phenyl-2H-1,2,3-triazol-4-yl]acetamide
Alternate Name(s) 2-cyano-N-[5-[(2-methyl-1H-indol-3-yl)-oxomethyl]-2-phenyl-4-triazolyl]acetamide 2-cyano-N-[5-(2-methyl-1H-indole-3-carbonyl)-2-phenyltriazol-4-yl]acetamide 2-cyano-N-[5-[(2-methyl-1H-indol-3-yl)carbonyl]-2-phenyl-1,2,3-triazol-4-yl]ethanamide
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H16N6O2
InChI InChI=1S/C21H16N6O2/c1-13-18(15-9-5-6-10-16(15)23-13)20(29)19-21(24-17(28)11-12-22)26-27(25-19)14-7-3-2-4-8-14/h2-10,23H,11H2,1H3,(H,24,26,28)
InChIKey HBIPBTDYBOTCKH-UHFFFAOYSA-N
Molecular Weight 384.399 g/mol
SMILES N(c1c(C(c2c([nH]c3c2cccc3)C)=O)n[n](n1)-c1ccccc1)C(CC#N)=O
SPLASH splash10-001i-0009000000-ecf07cee910c4e425296
Source of Spectrum F2-46-1817-5b
Wiley ID 1703994