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7,8-DIMETHOXY-4-(3',4'-DIMETHOXYBENZOYL)-5-METHYLENE-2,3-DIHYDRO-1,4-BENZOTHIAZEPINE
SpectraBase Compound ID K0IMNFBDZ6A
InChI InChI=1S/C21H23NO5S/c1-13-15-11-18(26-4)19(27-5)12-20(15)28-9-8-22(13)21(23)14-6-7-16(24-2)17(10-14)25-3/h6-7,10-12H,1,8-9H2,2-5H3
InChIKey SMGGWBBUOHPFML-UHFFFAOYSA-N
Mol Weight 401.48 g/mol
Molecular Formula C21H23NO5S
Exact Mass 401.129694 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IRBwVSGKYzg
Name 7,8-DIMETHOXY-4-(3',4'-DIMETHOXYBENZOYL)-5-METHYLENE-2,3-DIHYDRO-1,4-BENZOTHIAZEPINE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H23NO5S
InChI InChI=1S/C21H23NO5S/c1-13-15-11-18(26-4)19(27-5)12-20(15)28-9-8-22(13)21(23)14-6-7-16(24-2)17(10-14)25-3/h6-7,10-12H,1,8-9H2,2-5H3
InChIKey SMGGWBBUOHPFML-UHFFFAOYSA-N
Instrument Name Bruker WP-80
Literature Reference J.SZABO, G.BERNATH, A.KATOCS, P.SOHAR (1989) Acta Chimica Hungarica: v.126, N2,165-168.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d