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2-(ETHYLTHIO)-4H-3,1-BENZOTHIAZIN-4-ONE

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2-(ETHYLTHIO)-4H-3,1-BENZOTHIAZIN-4-ONE
SpectraBase Compound ID K4jkWfeKqJ4
InChI InChI=1S/C10H9NOS2/c1-2-13-10-11-8-6-4-3-5-7(8)9(12)14-10/h3-6H,2H2,1H3
InChIKey BUYSTTJTLCQEJP-UHFFFAOYSA-N
Mol Weight 223.31 g/mol
Molecular Formula C10H9NOS2
Exact Mass 223.012556 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7PPhLqVWifA
Name 2-(ETHYLTHIO)-4H-3,1-BENZOTHIAZIN-4-ONE
Compound Number 5J
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H9NOS2
InChI InChI=1S/C10H9NOS2/c1-2-13-10-11-8-6-4-3-5-7(8)9(12)14-10/h3-6H,2H2,1H3
InChIKey BUYSTTJTLCQEJP-UHFFFAOYSA-N
Literature Reference Author H.G.HAECKER,F.GRUNDMANN,F.LOHR,P.A.OTTERSBACH,J.ZHOU,G.SCHNA KENBURG,M.GUETSCHOW
Literature Reference Citation MOLECULES,14,378(2009)
Literature Reference DOI 10.3390/molecules14010378
Molecular Weight 223.308 g/mol
Sample ID 69071
Solvent DMSO-D6