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(3AS)-8,8-dimethyl-5,6-dihydro-3H,4H,7H-3a,6-methano-2,1-benzisothiazole-7-spiro-2'-1',3'-dithiolane 2,2-dioxide
SpectraBase Compound ID UBaBkwWDlc
InChI InChI=1S/C12H17NO2S3/c1-10(2)8-3-4-11(10)7-18(14,15)13-9(11)12(8)16-5-6-17-12/h8H,3-7H2,1-2H3/t8-,11+/m1/s1
InChIKey DXRQJHOVWOEUHE-KCJUWKMLSA-N
Mol Weight 303.45 g/mol
Molecular Formula C12H17NO2S3
Exact Mass 303.042142 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1Eo627d8pvF
Name (3AS)-8,8-dimethyl-5,6-dihydro-3H,4H,7H-3a,6-methano-2,1-benzisothiazole-7-spiro-2'-1',3'-dithiolane 2,2-dioxide
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Formula C12H17NO2S3
InChI InChI=1S/C12H17NO2S3/c1-10(2)8-3-4-11(10)7-18(14,15)13-9(11)12(8)16-5-6-17-12/h8H,3-7H2,1-2H3/t8-,11+/m1/s1
InChIKey DXRQJHOVWOEUHE-KCJUWKMLSA-N
Instrument Name Bruker AM-360
Literature Reference U. Verfuerth, R. Herrmann, J. Chem. Soc. Perkin I 2919 (1990).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3