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

*Links on SpectraBase are not permalinks.
3,3-Dimethyl-10-nitroso-11-(p-bromobenzoyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e]-[1,4]diazepin-1-one
SpectraBase Compound ID GmwTsLKuBEQ
InChI InChI=1S/C22H20BrN3O3/c1-22(2)11-16-19(18(27)12-22)20(21(28)13-7-9-14(23)10-8-13)26(25-29)17-6-4-3-5-15(17)24-16/h3-10,20,24H,11-12H2,1-2H3
InChIKey NZSQHIPFZMVXLF-UHFFFAOYSA-N
Mol Weight 454.32 g/mol
Molecular Formula C22H20BrN3O3
Exact Mass 453.068805 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 D1rFEL1RIkx
Name 3,3-Dimethyl-10-nitroso-11-(p-bromobenzoyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e]-[1,4]diazepin-1-one
Appearance Pale yellow crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H20BrN3O3
InChI InChI=1S/C22H20BrN3O3/c1-22(2)11-16-19(18(27)12-22)20(21(28)13-7-9-14(23)10-8-13)26(25-29)17-6-4-3-5-15(17)24-16/h3-10,20,24H,11-12H2,1-2H3
InChIKey NZSQHIPFZMVXLF-UHFFFAOYSA-N
Instrument Name Varian 1200 L
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.p009.195
Molecular Weight 454.324 g/mol
SMILES N1c2c(N(C(C3=C1CC(CC3=O)(C)C)C(=O)c1ccc(cc1)Br)N=O)cccc2
SPLASH splash10-0540-2910000000-84d392f0a1e71b987144
Source of Spectrum ARK-2015-SM11-8c
Wiley ID 1845670