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2(3H)-benzothiazolone

View entire compound with spectra: 31 NMR, 4 FTIR, 1 Raman, and 7 MS (GC)

2(3H)-benzothiazolone
SpectraBase Compound ID Jcv701QuaBw
InChI InChI=1S/C7H5NOS/c9-7-8-5-3-1-2-4-6(5)10-7/h1-4H,(H,8,9)
InChIKey YEDUAINPPJYDJZ-UHFFFAOYSA-N
Mol Weight 151.18 g/mol
Molecular Formula C7H5NOS
Exact Mass 151.009185 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7BBSZdPdLnN
Name Benzothiazolin-2-one
CAS Registry Number 934-34-9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H5NOS
InChI InChI=1S/C7H5NOS/c9-7-8-5-3-1-2-4-6(5)10-7/h1-4H,(H,8,9)
InChIKey YEDUAINPPJYDJZ-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference R. Faure, J. Elguero, E.J. Vincent, Org. Magn. Resonance 11, 617 (1978).
NMR Standard DMSO-D6
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6