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2-(3H)-[(Z)-ACETYL-(ETHOXYCARBONYL)-METHYLENE]-BENZOTHIAZOLE
SpectraBase Compound ID JaePADwcV2h
InChI InChI=1S/C13H13NO3S/c1-3-17-13(16)11(8(2)15)12-14-9-6-4-5-7-10(9)18-12/h4-7,14H,3H2,1-2H3/b12-11-
InChIKey NOUJGLJHQIMWNH-QXMHVHEDSA-N
Mol Weight 263.31 g/mol
Molecular Formula C13H13NO3S
Exact Mass 263.061614 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AjNOZUaDRZf
Name 2-(3H)-[(Z)-ACETYL-(ETHOXYCARBONYL)-METHYLENE]-BENZOTHIAZOLE
CAS Registry Number 123150-23-2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H13NO3S
InChI InChI=1S/C13H13NO3S/c1-3-17-13(16)11(8(2)15)12-14-9-6-4-5-7-10(9)18-12/h4-7,14H,3H2,1-2H3/b12-11-
InChIKey NOUJGLJHQIMWNH-QXMHVHEDSA-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 263.311 g/mol
Solvent CDCl3
Source File Reference UWED10590