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1-[3-(2-benzoxyphenyl)-4-(3,4-dimethylphenyl)-2-phenyl-3H-1,2,4-triazol-5-yl]ethanone
SpectraBase Compound ID KRr74vijuCX
InChI InChI=1S/C31H29N3O2/c1-22-18-19-27(20-23(22)2)33-30(24(3)35)32-34(26-14-8-5-9-15-26)31(33)28-16-10-11-17-29(28)36-21-25-12-6-4-7-13-25/h4-20,31H,21H2,1-3H3
InChIKey NQQYGCNESQJJPX-UHFFFAOYSA-N
Mol Weight 475.59 g/mol
Molecular Formula C31H29N3O2
Exact Mass 475.225977 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FZcQsNm1nEH
Name 1-[3-(2-benzoxyphenyl)-4-(3,4-dimethylphenyl)-2-phenyl-3H-1,2,4-triazol-5-yl]ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H29N3O2
InChI InChI=1S/C31H29N3O2/c1-22-18-19-27(20-23(22)2)33-30(24(3)35)32-34(26-14-8-5-9-15-26)31(33)28-16-10-11-17-29(28)36-21-25-12-6-4-7-13-25/h4-20,31H,21H2,1-3H3
InChIKey NQQYGCNESQJJPX-UHFFFAOYSA-N
Molecular Weight 475.592 g/mol
SMILES c1ccc(N2C(N(C(=N2)C(=O)C)c2cc(C)c(cc2)C)c2c(OCc3ccccc3)cccc2)cc1
SPLASH splash10-0006-1191400000-6763f4dadd30aa840de8
Synonyms 1-[3-(2-benzyloxyphenyl)-4-(3,4-dimethylphenyl)-2-phenyl-3H-1,2,4-triazol-5-yl]ethanone 1-[4-(3,4-dimethylphenyl)-2-phenyl-3-(2-phenylmethoxyphenyl)-3H-1,2,4-triazol-5-yl]ethanone
Wiley ID 1454696