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ZWQLPHAEKKUAQX-UHFFFAOYSA-N
SpectraBase Compound ID 163C69iWAQb
InChI InChI=1S/C19H13NO2S/c1-12-6-8-13(9-7-12)18(22)14-10-11-17(21)20-15-4-2-3-5-16(15)23-19(14)20/h2-11H,1H3
InChIKey ZWQLPHAEKKUAQX-UHFFFAOYSA-N
Mol Weight 319.38 g/mol
Molecular Formula C19H13NO2S
Exact Mass 319.0667 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8tGIpk9kcbv
Name 4-(4-METHYLBENZOYL)-1H-PYRIDO-[2,1-B]-BENZOTHIAZOL-1-ONE
CAS Registry Number 123150-33-4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H13NO2S
InChI InChI=1S/C19H13NO2S/c1-12-6-8-13(9-7-12)18(22)14-10-11-17(21)20-15-4-2-3-5-16(15)23-19(14)20/h2-11H,1H3
InChIKey ZWQLPHAEKKUAQX-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 319.378 g/mol
Solvent CDCl3
Source File Reference UWED10604