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

*Links on SpectraBase are not permalinks.
N-Cyclohexyl-3-ethyl-4-(4-fluorobenzoyl)-2-phenyl-4,5-dihydro-3H-1,4-benzodiazepine-5-carboxamide
SpectraBase Compound ID 2kpRXgJa5fP
InChI InChI=1S/C31H32FN3O2/c1-2-27-28(21-11-5-3-6-12-21)34-26-16-10-9-15-25(26)29(30(36)33-24-13-7-4-8-14-24)35(27)31(37)22-17-19-23(32)20-18-22/h3,5-6,9-12,15-20,24,27,29H,2,4,7-8,13-14H2,1H3,(H,33,36)
InChIKey UOMGXDTUOVVCIP-UHFFFAOYSA-N
Mol Weight 497.6 g/mol
Molecular Formula C31H32FN3O2
Exact Mass 497.247855 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 KpxN0E5CgJ
Name N-Cyclohexyl-3-ethyl-4-(4-fluorobenzoyl)-2-phenyl-4,5-dihydro-3H-1,4-benzodiazepine-5-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H32FN3O2
InChI InChI=1S/C31H32FN3O2/c1-2-27-28(21-11-5-3-6-12-21)34-26-16-10-9-15-25(26)29(30(36)33-24-13-7-4-8-14-24)35(27)31(37)22-17-19-23(32)20-18-22/h3,5-6,9-12,15-20,24,27,29H,2,4,7-8,13-14H2,1H3,(H,33,36)
InChIKey UOMGXDTUOVVCIP-UHFFFAOYSA-N
Molecular Weight 497.614 g/mol
SMILES N(C(C1N(C(C(=Nc2c1cccc2)c1ccccc1)CC)C(c1ccc(cc1)F)=O)=O)C1CCCCC1
SPLASH splash10-00di-0916000000-3e27cfe9772febbe0318
Source of Spectrum F-69-9060-12k
Synonyms N-cyclohexyl-3-ethyl-4-(4-fluorobenzoyl)-2-phenyl-4,5-dihydro-3H-benzo[e][1,4]diazepine-5-carboxamide
Wiley ID 1738592