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(2E,4E)-2-Cyano-N-[5-(2-methyl-1H-indole-3-carbonyl)-2-phenyl-2H-1,2,3-triazol-4-yl]-5-phenylpenta-2,4-dienamide
SpectraBase Compound ID 1QUmhhIgLwW
InChI InChI=1S/C30H22N6O2/c1-20-26(24-17-8-9-18-25(24)32-20)28(37)27-29(35-36(34-27)23-15-6-3-7-16-23)33-30(38)22(19-31)14-10-13-21-11-4-2-5-12-21/h2-18,32H,1H3,(H,33,35,38)/b13-10+,22-14+
InChIKey VQUJWAFYWRWZCT-IRMYMQKMSA-N
Mol Weight 498.55 g/mol
Molecular Formula C30H22N6O2
Exact Mass 498.180424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HbXEL7peQQm
Name (2E,4E)-2-Cyano-N-[5-(2-methyl-1H-indole-3-carbonyl)-2-phenyl-2H-1,2,3-triazol-4-yl]-5-phenylpenta-2,4-dienamide
Comments Less than 3 mono-isotopic peaks
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Formula C30H22N6O2
InChI InChI=1S/C30H22N6O2/c1-20-26(24-17-8-9-18-25(24)32-20)28(37)27-29(35-36(34-27)23-15-6-3-7-16-23)33-30(38)22(19-31)14-10-13-21-11-4-2-5-12-21/h2-18,32H,1H3,(H,33,35,38)/b13-10+,22-14+
InChIKey VQUJWAFYWRWZCT-IRMYMQKMSA-N
Molecular Weight 498.546 g/mol
SMILES N(c1c(C(c2c([nH]c3c2cccc3)C)=O)n[n](n1)-c1ccccc1)C(\C(C#N)=C\C=C\c1ccccc1)=O
SPLASH splash10-0002-0000900000-b20dc0043240fc61ebd3
Source of Spectrum F2-46-1819-18b
Synonyms (2E,4E)-2-cyano-N-[5-[(2-methyl-1H-indol-3-yl)-oxomethyl]-2-phenyl-4-triazolyl]-5-phenylpenta-2,4-dienamide (2E,4E)-2-cyano-N-[5-(2-methyl-1H-indole-3-carbonyl)-2-phenyltriazol-4-yl]-5-phenylpenta-2,4-dienamide (2E,4E)-2-cyano-N-[5-[(2-methyl-1H-indol-3-yl)carbonyl]-2-phenyl-1,2,3-triazol-4-yl]-5-phenyl-penta-2,4-dienamide
Wiley ID 1703979