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2H-1,4-Benzothiazine-3(4H)-one
SpectraBase Compound ID 6V77cCQ7sDr
InChI InChI=1S/C8H7NOS/c10-8-5-11-7-4-2-1-3-6(7)9-8/h1-4H,5H2,(H,9,10)
InChIKey GTFMIJNXNMDHAB-UHFFFAOYSA-N
Mol Weight 165.21 g/mol
Molecular Formula C8H7NOS
Exact Mass 165.024835 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6VJRXOwKDc3
Name 1,4(2H)-BENZOTHIAZIN-3(4H)-ONE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H7NOS
InChI InChI=1S/C8H7NOS/c10-8-5-11-7-4-2-1-3-6(7)9-8/h1-4H,5H2,(H,9,10)
InChIKey GTFMIJNXNMDHAB-UHFFFAOYSA-N
Literature Reference Author M.S.MORALES-RIOS,H.CERVANTES-CUEVAS,I.SALGADO-ESCOBAR,P.JOSE PH-NATHAN
Literature Reference Citation MAGN.RES.CHEM.,37,243(1999)
Literature Reference DOI 10.1002/(sici)1097-458x(199903)37:3<243::aid-mrc431>3.0.co;2-x
Molecular Weight 165.210 g/mol
Solvent DMSO-D6;C=0.6M
Source File Reference UWCS23676