For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-[4-(3-chloranyl-4-piperidin-1-yl-phenyl)-3-(3,4-dimethoxyphenyl)-2-(4-methylphenyl)-3H-1,2,4-triazol-5-yl]ethanone
SpectraBase Compound ID 2DtCO0ldsKQ
InChI InChI=1S/C30H33ClN4O3/c1-20-8-11-23(12-9-20)35-30(22-10-15-27(37-3)28(18-22)38-4)34(29(32-35)21(2)36)24-13-14-26(25(31)19-24)33-16-6-5-7-17-33/h8-15,18-19,30H,5-7,16-17H2,1-4H3
InChIKey GKJADMKNWIFAAO-UHFFFAOYSA-N
Mol Weight 533.1 g/mol
Molecular Formula C30H33ClN4O3
Exact Mass 532.224119 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID J7lHn4DxJba
Name 1-[4-(3-chloranyl-4-piperidin-1-yl-phenyl)-3-(3,4-dimethoxyphenyl)-2-(4-methylphenyl)-3H-1,2,4-triazol-5-yl]ethanone
Alternate Name(s) 1-[4-(3-chloro-4-piperidin-1-ylphenyl)-3-(3,4-dimethoxyphenyl)-2-(4-methylphenyl)-3H-1,2,4-triazol-5-yl]ethanone 1-[4-(3-chloro-4-piperidino-phenyl)-3-(3,4-dimethoxyphenyl)-2-(p-tolyl)-3H-1,2,4-triazol-5-yl]ethanone 1-[4-[3-chloro-4-(1-piperidinyl)phenyl]-3-(3,4-dimethoxyphenyl)-2-(4-methylphenyl)-3H-1,2,4-triazol-5-yl]ethanone 1-[4-[3-chloro-4-(1-piperidinyl)phenyl]-5-(3,4-dimethoxyphenyl)-1-(4-methylphenyl)-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethanone 1-[4-[3-chloro-4-(1-piperidyl)phenyl]-3-(3,4-dimethoxyphenyl)-2-(p-tolyl)-3H-1,2,4-triazol-5-yl]ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H33ClN4O3
InChI InChI=1S/C30H33ClN4O3/c1-20-8-11-23(12-9-20)35-30(22-10-15-27(37-3)28(18-22)38-4)34(29(32-35)21(2)36)24-13-14-26(25(31)19-24)33-16-6-5-7-17-33/h8-15,18-19,30H,5-7,16-17H2,1-4H3
InChIKey GKJADMKNWIFAAO-UHFFFAOYSA-N
Molecular Weight 533.072 g/mol
SMILES C1CCN(c2ccc(N3C(=NN(C3c3cc(OC)c(cc3)OC)c3ccc(cc3)C)C(=O)C)cc2Cl)CC1
SPLASH splash10-000t-0019050000-9a2e3b708a0158787c16
Wiley ID 1454717