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3-METHYL-BENZO-[D]-ISOTHIAZOLE

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3-METHYL-BENZO-[D]-ISOTHIAZOLE
SpectraBase Compound ID A686w7abnbb
InChI InChI=1S/C8H7NS/c1-6-7-4-2-3-5-8(7)10-9-6/h2-5H,1H3
InChIKey DAEGDNYLKMKZRG-UHFFFAOYSA-N
Mol Weight 149.21 g/mol
Molecular Formula C8H7NS
Exact Mass 149.02992 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GonHGVHJjIM
Name 3-METHYL-BENZO-[D]-ISOTHIAZOLE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H7NS
InChI InChI=1S/C8H7NS/c1-6-7-4-2-3-5-8(7)10-9-6/h2-5H,1H3
InChIKey DAEGDNYLKMKZRG-UHFFFAOYSA-N
Literature Reference Author S.CHIMICHI,B.COSIMELLI,P.TEDESCHI,F.PONTICELLI
Literature Reference Citation MAGN.RES.CHEM.,32,312(1994)
Literature Reference DOI 10.1002/mrc.1260320510
Molecular Weight 149.210 g/mol
Solvent CDCl3
Source File Reference UWCP863