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QCDLFVBODBGGDJ-UHFFFAOYSA-N

View entire compound with spectra: 2 NMR

QCDLFVBODBGGDJ-UHFFFAOYSA-N
SpectraBase Compound ID C2QJnanPhtw
InChI InChI=1S/C23H20ClN3O2S/c1-28-19-12-18-21(13-20(19)29-2)30-14-26-22(15-8-10-16(24)11-9-15)25-27(23(18)26)17-6-4-3-5-7-17/h3-13,23H,14H2,1-2H3
InChIKey QCDLFVBODBGGDJ-UHFFFAOYSA-N
Mol Weight 437.95 g/mol
Molecular Formula C23H20ClN3O2S
Exact Mass 437.096476 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J70qKTDXZoI
Name 3-(4-Chloro-phenyl)-8,9-dimethoxy-1-phenyl-S-triazolo(4,3-C)-5H-1,3-benzothiazine
CAS Registry Number 90040-88-3
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C23H20ClN3O2S
InChI InChI=1S/C23H20ClN3O2S/c1-28-19-12-18-21(13-20(19)29-2)30-14-26-22(15-8-10-16(24)11-9-15)25-27(23(18)26)17-6-4-3-5-7-17/h3-13,23H,14H2,1-2H3
InChIKey QCDLFVBODBGGDJ-UHFFFAOYSA-N
Instrument Name Bruker WP-80
Literature Reference P. Sohar, L. Fodor, J. Szabo, G. Bernath, Org. Magn. Resonance 22, 720 (1984).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3