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(4AS, 8R,8aR)-8-bromo-9,9-dimethyl-5,6,7,8-tetrahydro-4H-4a,7-methano-oxazirino(3,2-I)(2,1)benzisothiazole 3,3-dioxide
SpectraBase Compound ID 8LJLTHz3TRa
InChI InChI=1S/C10H14BrNO3S/c1-8(2)6-3-4-9(8)5-16(13,14)12-10(9,15-12)7(6)11/h6-7H,3-5H2,1-2H3/t6-,7-,9-,10-,12?/m0/s1
InChIKey CECPSNLTUWYZDY-FTYASTTCSA-N
Mol Weight 308.19 g/mol
Molecular Formula C10H14BrNO3S
Exact Mass 306.987777 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5rzi5fCJJiR
Name (4AS, 8S,8aR)-8-bromo-9,9-dimethyl-5,6,7,8-tetrahydro-4H-4a,7-methano-oxazirino(3,2-I)(2,1)benzisothiazole 3,3-dioxide
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Formula C10H14BrNO3S
InChI InChI=1S/C10H14BrNO3S/c1-8(2)6-3-4-9(8)5-16(13,14)12-10(9,15-12)7(6)11/h6-7H,3-5H2,1-2H3/t6-,7-,9-,10-,12?/m0/s1
InChIKey CECPSNLTUWYZDY-FTYASTTCSA-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