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2-(3H)-[(4-METHYLBENZOYL)-METHYLENE]-BENZOTHIAZOLE
SpectraBase Compound ID HPJWvrczndq
InChI InChI=1S/C16H13NOS/c1-11-6-8-12(9-7-11)14(18)10-16-17-13-4-2-3-5-15(13)19-16/h2-10,17H,1H3/b16-10-
InChIKey UPOFBUBAIDHGOK-YBEGLDIGSA-N
Mol Weight 267.35 g/mol
Molecular Formula C16H13NOS
Exact Mass 267.071785 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A3z0cul2335
Name 2-(3H)-[(4-METHYLBENZOYL)-METHYLENE]-BENZOTHIAZOLE
CAS Registry Number 123150-28-7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H13NOS
InChI InChI=1S/C16H13NOS/c1-11-6-8-12(9-7-11)14(18)10-16-17-13-4-2-3-5-15(13)19-16/h2-10,17H,1H3/b16-10-
InChIKey UPOFBUBAIDHGOK-YBEGLDIGSA-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 267.345 g/mol
Solvent CDCl3
Source File Reference UWED10597