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

*Links on SpectraBase are not permalinks.

2-(4-tert-Butoxy-benzyl)-4-[2-(4-methoxy-phenyl)-ethyl]-7-nitro-3-oxo-1,2,4,5-tetrahydro-3H-1,4-benzodiazepin-3-one

View entire compound with spectra: 2 MS (GC)

2-(4-tert-Butoxy-benzyl)-4-[2-(4-methoxy-phenyl)-ethyl]-7-nitro-3-oxo-1,2,4,5-tetrahydro-3H-1,4-benzodiazepin-3-one
SpectraBase Compound ID 28xIdZ9IoYu
InChI InChI=1S/C29H33N3O5/c1-29(2,3)37-25-12-7-21(8-13-25)17-27-28(33)31(16-15-20-5-10-24(36-4)11-6-20)19-22-18-23(32(34)35)9-14-26(22)30-27/h5-14,18,27,30H,15-17,19H2,1-4H3
InChIKey RPLKJALZUDXMFX-UHFFFAOYSA-N
Mol Weight 503.6 g/mol
Molecular Formula C29H33N3O5
Exact Mass 503.242021 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 8hOQd6gBhA5
Name 2-(4-tert-Butoxy-benzyl)-4-[2-(4-methoxy-phenyl)-ethyl]-7-nitro-3-oxo-1,2,4,5-tetrahydro-3H-1,4-benzodiazepin-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H33N3O5
InChI InChI=1S/C29H33N3O5/c1-29(2,3)37-25-12-7-21(8-13-25)17-27-28(33)31(16-15-20-5-10-24(36-4)11-6-20)19-22-18-23(32(34)35)9-14-26(22)30-27/h5-14,18,27,30H,15-17,19H2,1-4H3
InChIKey RPLKJALZUDXMFX-UHFFFAOYSA-N
Molecular Weight 503.599 g/mol
SMILES N1c2c(CN(C(C1Cc1ccc(OC(C)(C)C)cc1)=O)CCc1ccc(OC)cc1)cc(cc2)N(=O)=O
SPLASH splash10-0005-0007900000-d445662c69fee6d99a3b
Source of Spectrum F-65-4525-5
Synonyms 2-(4-tert-Butoxybenzyl)-4-[2-(4-methoxyphenyl)ethyl]-7-nitro-1,2,4,5-tetrahydro-3H-1,4-benzodiazepin-3-one
Wiley ID 1680986