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1-[2-(4-chlorophenyl)-3-[4-[(2-chlorophenyl)methoxy]phenyl]-4-phenyl-3H-1,2,4-triazol-5-yl]ethanone
SpectraBase Compound ID BqocM8kBpbq
InChI InChI=1S/C29H23Cl2N3O2/c1-20(35)28-32-34(25-15-13-23(30)14-16-25)29(33(28)24-8-3-2-4-9-24)21-11-17-26(18-12-21)36-19-22-7-5-6-10-27(22)31/h2-18,29H,19H2,1H3
InChIKey KYNVVRCFFRYXKS-UHFFFAOYSA-N
Mol Weight 516.43 g/mol
Molecular Formula C29H23Cl2N3O2
Exact Mass 515.116732 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4AZ2ErCTOig
Name 1-[2-(4-chlorophenyl)-3-[4-[(2-chlorophenyl)methoxy]phenyl]-4-phenyl-3H-1,2,4-triazol-5-yl]ethanone
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Formula C29H23Cl2N3O2
InChI InChI=1S/C29H23Cl2N3O2/c1-20(35)28-32-34(25-15-13-23(30)14-16-25)29(33(28)24-8-3-2-4-9-24)21-11-17-26(18-12-21)36-19-22-7-5-6-10-27(22)31/h2-18,29H,19H2,1H3
InChIKey KYNVVRCFFRYXKS-UHFFFAOYSA-N
Molecular Weight 516.428 g/mol
SMILES c1ccc(N2C(=NN(C2c2ccc(OCc3c(Cl)cccc3)cc2)c2ccc(cc2)Cl)C(=O)C)cc1
SPLASH splash10-004i-3931010000-ce503fa6577a0aaa73d8
Synonyms 1-[3-[4-(2-chlorobenzyl)oxyphenyl]-2-(4-chlorophenyl)-4-phenyl-3H-1,2,4-triazol-5-yl]ethanone
Wiley ID 1437404