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4,5,6,7-TETRAHYDRO-1,2-BENZOTHIAZOL-3(2H)-ON-1,1-DIOXIDE
SpectraBase Compound ID 2woxWOJIO0H
InChI InChI=1S/C7H9NO3S/c9-7-5-3-1-2-4-6(5)12(10,11)8-7/h1-4H2,(H,8,9)
InChIKey ZQYWVWZVMZOZIB-UHFFFAOYSA-N
Mol Weight 187.21 g/mol
Molecular Formula C7H9NO3S
Exact Mass 187.030314 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5QxB9xgiJvj
Name 4,5,6,7-TETRAHYDRO-1,2-BENZOTHIAZOL-3(2H)-ON-1,1-DIOXIDE
Compound Number 10L
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H9NO3S
InChI InChI=1S/C7H9NO3S/c9-7-5-3-1-2-4-6(5)12(10,11)8-7/h1-4H2,(H,8,9)
InChIKey ZQYWVWZVMZOZIB-UHFFFAOYSA-N
Literature Reference Author B.SCHULZE,G.KIRSTEN,S.KIRRBACH,A.RAHM,H.HEIMGARTNER
Literature Reference Citation HELV.CHIM.ACTA,74,1059(1991)
Literature Reference DOI 10.1002/hlca.19910740515
Molecular Weight 187.213 g/mol
Solvent DMSO-D6
Source File Reference UWVP320