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

*Links on SpectraBase are not permalinks.
1-(4-(Diphenylphosphoryl)-4-methyl-4,5-dihydro-1H-benzo-[c]azepin-2(3H)-yl)ethanone
SpectraBase Compound ID APXz07ACdhs
InChI InChI=1S/C25H26NO2P/c1-20(27)26-18-22-12-10-9-11-21(22)17-25(2,19-26)29(28,23-13-5-3-6-14-23)24-15-7-4-8-16-24/h3-16H,17-19H2,1-2H3
InChIKey BYYGRHURMJKSJH-UHFFFAOYSA-N
Mol Weight 403.46 g/mol
Molecular Formula C25H26NO2P
Exact Mass 403.170116 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 7mHxyv8sniE
Name 1-(4-(Diphenylphosphoryl)-4-methyl-4,5-dihydro-1H-benzo-[c]azepin-2(3H)-yl)ethanone
Appearance White wax
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 403.170116077 u
Formula C25H26NO2P
GC Column DB-5 (30 m x 0.25 mm)
InChI InChI=1S/C25H26NO2P/c1-20(27)26-18-22-12-10-9-11-21(22)17-25(2,19-26)29(28,23-13-5-3-6-14-23)24-15-7-4-8-16-24/h3-16H,17-19H2,1-2H3
InChIKey BYYGRHURMJKSJH-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1021/jo4001788
Molecular Weight 403.462 g/mol
Reported Formula C25H26NO2P
SMILES C1=CC=CC2=C1CC(CN(C2)C(C)=O)(C)P(C1=CC=CC=C1)(C1=CC=CC=C1)=O
SPLASH splash10-0j4l-0095200000-f8d674dcbe385112a228
Source of Spectrum JOC-78-4727-17b-endo (DOI: 10.1021/jo4001788)
Wiley ID 1912110