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

*Links on SpectraBase are not permalinks.

2-Carbomethoxy-3-(3,4-dimethoxy-phenyl)-7,8-dimethoxy-4,5-dihydro-1,4-benzothiazepine

View entire compound with spectra: 1 NMR

2-Carbomethoxy-3-(3,4-dimethoxy-phenyl)-7,8-dimethoxy-4,5-dihydro-1,4-benzothiazepine
SpectraBase Compound ID UPQKR0URSu
InChI InChI=1S/C21H23NO6S/c1-24-14-7-6-12(8-15(14)25-2)19-20(21(23)28-5)29-18-10-17(27-4)16(26-3)9-13(18)11-22-19/h6-10,22H,11H2,1-5H3
InChIKey WGOLAJLAECCHKH-UHFFFAOYSA-N
Mol Weight 417.48 g/mol
Molecular Formula C21H23NO6S
Exact Mass 417.124609 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 HRSkTnnSRa7
Name 2-Carbomethoxy-3-(3,4-dimethoxy-phenyl)-7,8-dimethoxy-4,5-dihydro-1,4-benzothiazepine
CAS Registry Number 97326-08-4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H23NO6S
InChI InChI=1S/C21H23NO6S/c1-24-14-7-6-12(8-15(14)25-2)19-20(21(23)28-5)29-18-10-17(27-4)16(26-3)9-13(18)11-22-19/h6-10,22H,11H2,1-5H3
InChIKey WGOLAJLAECCHKH-UHFFFAOYSA-N
Instrument Name Bruker WM-250
Literature Reference L. Fodor, J. Szabo, Tetrahedron 40, 4089 (1984).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3