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2,1-benzisothiazole

View entire compound with spectra: 20 NMR, and 1 FTIR

2,1-benzisothiazole
SpectraBase Compound ID D8bwUWWmNM9
InChI InChI=1S/C7H5NS/c1-2-4-7-6(3-1)5-9-8-7/h1-5H
InChIKey JGQPSDIWMGNAPE-UHFFFAOYSA-N
Mol Weight 135.18 g/mol
Molecular Formula C7H5NS
Exact Mass 135.01427 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4M2tUCxgINj
Name BENZO-[C]-ISOTHIAZOL
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H5NS
InChI InChI=1S/C7H5NS/c1-2-4-7-6(3-1)5-9-8-7/h1-5H
InChIKey JGQPSDIWMGNAPE-UHFFFAOYSA-N
Literature Reference Author N.PLAVAC,I.W.J.STILL,M.S.CHAUHAN,D.M.MCKINNON
Literature Reference Citation CAN.J.CHEM.,53,836(1975)
Literature Reference DOI 10.1139/v75-117
Molecular Weight 135.183 g/mol
Solvent CDCl3
Source File Reference UNIW1716