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METHYL-4-(4-METHOXYBENZOYL)-1-OXO-1H-PYRIDO-[2,1-B]-BENZOTHIAZOLE-3-CARBOXYLATE
SpectraBase Compound ID DByQw77NvLb
InChI InChI=1S/C21H15NO5S/c1-26-13-9-7-12(8-10-13)19(24)18-14(21(25)27-2)11-17(23)22-15-5-3-4-6-16(15)28-20(18)22/h3-11H,1-2H3
InChIKey SRLKDOKWNBZLAI-UHFFFAOYSA-N
Mol Weight 393.41 g/mol
Molecular Formula C21H15NO5S
Exact Mass 393.067094 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1CJpBRHAk0f
Name METHYL-4-(4-METHOXYBENZOYL)-1-OXO-1H-PYRIDO-[2,1-B]-BENZOTHIAZOLE-3-CARBOXYLATE
CAS Registry Number 123150-39-0
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H15NO5S
InChI InChI=1S/C21H15NO5S/c1-26-13-9-7-12(8-10-13)19(24)18-14(21(25)27-2)11-17(23)22-15-5-3-4-6-16(15)28-20(18)22/h3-11H,1-2H3
InChIKey SRLKDOKWNBZLAI-UHFFFAOYSA-N
Literature Reference Author Z.T.HUANG,X.SHI
Literature Reference Citation CHEM.BER.,123,541(1990)
Literature Reference DOI 10.1002/cber.19901230321
Molecular Weight 393.414 g/mol
Solvent DMSO-D6
Source File Reference UWED10610