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2-(tetrahydropyran-2-yl)-1,2-benzisothiazolin-3-one, 1,1-dioxide
SpectraBase Compound ID A9Cr2K1f1jc
InChI InChI=1S/C12H13NO4S/c14-12-9-5-1-2-6-10(9)18(15,16)13(12)11-7-3-4-8-17-11/h1-2,5-6,11H,3-4,7-8H2
InChIKey POWRSXARLNKFNJ-UHFFFAOYSA-N
Mol Weight 267.3 g/mol
Molecular Formula C12H13NO4S
Exact Mass 267.056529 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CRfd4Jf3GFZ
Name 2-(tetrahydropyran-2-yl)-1,2-benzisothiazolin-3-one, 1,1-dioxide
Source of Sample A. J. Speziale & K. W. Ratts, Monsanto Chemical Company, St. Louis, Missouri
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Formula C12H13NO4S
InChI InChI=1S/C12H13NO4S/c14-12-9-5-1-2-6-10(9)18(15,16)13(12)11-7-3-4-8-17-11/h1-2,5-6,11H,3-4,7-8H2
InChIKey POWRSXARLNKFNJ-UHFFFAOYSA-N
Instrument Name Varian A-60
Sadtler NMR Number 7064M
Solvent CDCl3
Synonyms SACCHARIN, N-/TETRAHYDRO- 2-PYRANYL/-, 1,2-BENZISOTHIAZOLIN-3-ONE, 2-/TETRA- HYDRO-2-PYRANYL/-, -1,1-DIOXIDE