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Benzothiazole, 2-(methylthio)-

View entire compound with spectra: 15 NMR, 3 FTIR, 1 Raman, and 15 MS (GC)

Benzothiazole, 2-(methylthio)-
SpectraBase Compound ID 9FyVKO7cg2H
InChI InChI=1S/C8H7NS2/c1-10-8-9-6-4-2-3-5-7(6)11-8/h2-5H,1H3
InChIKey UTBVIMLZIRIFFR-UHFFFAOYSA-N
Mol Weight 181.27 g/mol
Molecular Formula C8H7NS2
Exact Mass 181.001992 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID TOKwazQ7Ub
Name 2-Methylthio-benzothiazol
CAS Registry Number 615-22-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H7NS2
InChI InChI=1S/C8H7NS2/c1-10-8-9-6-4-2-3-5-7(6)11-8/h2-5H,1H3
InChIKey UTBVIMLZIRIFFR-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