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

*Links on SpectraBase are not permalinks.

2-(4-Nitrophenyl)-2,3,4,5-tetrahydro-1,5-benzothiazepin-4-on

View entire compound with spectra: 2 NMR, and 1 MS (GC)

2-(4-Nitrophenyl)-2,3,4,5-tetrahydro-1,5-benzothiazepin-4-on
SpectraBase Compound ID JyZJBOhwLdW
InChI InChI=1S/C15H12N2O3S/c18-15-9-14(10-5-7-11(8-6-10)17(19)20)21-13-4-2-1-3-12(13)16-15/h1-8,14H,9H2,(H,16,18)
InChIKey WFOHNGHRODWGLU-UHFFFAOYSA-N
Mol Weight 300.33 g/mol
Molecular Formula C15H12N2O3S
Exact Mass 300.056863 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID K00qxqIybC0
Name 2-(4-Nitrophenyl)-2,3,4,5-tetrahydro-1,5-benzothiazepin-4-on
CAS Registry Number 97037-99-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H12N2O3S
InChI InChI=1S/C15H12N2O3S/c18-15-9-14(10-5-7-11(8-6-10)17(19)20)21-13-4-2-1-3-12(13)16-15/h1-8,14H,9H2,(H,16,18)
InChIKey WFOHNGHRODWGLU-UHFFFAOYSA-N
Literature Reference Liebigs Ann. Chem. 869 (1985).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6