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

*Links on SpectraBase are not permalinks.
N-Cyclohexyl 4-(4-methylbenzyl)-2-phenyl-5-oxo-(R/S)-6-methyl-4,5,6,7-tetrahydro-1H-1,4-diazepine-3-carboxamide
SpectraBase Compound ID DmSrI27gdEZ
InChI InChI=1S/C27H33N3O2/c1-19-13-15-21(16-14-19)18-30-25(26(31)29-23-11-7-4-8-12-23)24(22-9-5-3-6-10-22)28-17-20(2)27(30)32/h3,5-6,9-10,13-16,20,23,28H,4,7-8,11-12,17-18H2,1-2H3,(H,29,31)/t20-/m1/s1
InChIKey MWHGXZWKVUMGBE-HXUWFJFHSA-N
Mol Weight 431.6 g/mol
Molecular Formula C27H33N3O2
Exact Mass 431.257277 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 CWBXpRNpl0J
Name N-Cyclohexyl 4-(4-methylbenzyl)-2-phenyl-5-oxo-(R/S)-6-methyl-4,5,6,7-tetrahydro-1H-1,4-diazepine-3-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H33N3O2
InChI InChI=1S/C27H33N3O2/c1-19-13-15-21(16-14-19)18-30-25(26(31)29-23-11-7-4-8-12-23)24(22-9-5-3-6-10-22)28-17-20(2)27(30)32/h3,5-6,9-10,13-16,20,23,28H,4,7-8,11-12,17-18H2,1-2H3,(H,29,31)/t20-/m1/s1
InChIKey MWHGXZWKVUMGBE-HXUWFJFHSA-N
Molecular Weight 431.580 g/mol
SMILES N1C[C@](C(N(C(C(NC2CCCCC2)=O)=C1c1ccccc1)Cc1ccc(cc1)C)=O)(C)[H]
SPLASH splash10-0059-0537900000-c55b9ecded97291b2faa
Source of Spectrum F-66-6786-6h
Wiley ID 1684237