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3-methyl-2-benzothiazolinethione

View entire compound with spectra: 9 NMR, 2 FTIR, 1 UV-Vis, and 3 MS (GC)

3-methyl-2-benzothiazolinethione
SpectraBase Compound ID DX0MTnNSALp
InChI InChI=1S/C8H7NS2/c1-9-6-4-2-3-5-7(6)11-8(9)10/h2-5H,1H3
InChIKey IRNRNPNZAKHEAW-UHFFFAOYSA-N
Mol Weight 181.27 g/mol
Molecular Formula C8H7NS2
Exact Mass 181.001992 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2NweLMU33oh
Name 3-Methylbenzothiazole-2-thione
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number M30000
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7NS2
InChI InChI=1S/C8H7NS2/c1-9-6-4-2-3-5-7(6)11-8(9)10/h2-5H,1H3
InChIKey IRNRNPNZAKHEAW-UHFFFAOYSA-N
Molecular Weight 181.271 g/mol
Observed nucleus 13C
Purity 99%
Solvent CDCl3 & DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_015205