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(3R,4R)-3-(bromomethyl)-4-[(4-methylphenyl)sulfonylmethyl]sulfolane
SpectraBase Compound ID LFzfh27DZfY
InChI InChI=1S/C13H17BrO4S2/c1-10-2-4-13(5-3-10)20(17,18)9-12-8-19(15,16)7-11(12)6-14/h2-5,11-12H,6-9H2,1H3/t11-,12+/m0/s1
InChIKey JOXKSOSBQMESSX-NWDGAFQWSA-N
Mol Weight 381.3 g/mol
Molecular Formula C13H17BrO4S2
Exact Mass 379.975164 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D5shQmQpo1A
Name (3R,4R)-3-(bromomethyl)-4-[(4-methylphenyl)sulfonylmethyl]sulfolane
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H17BrO4S2
InChI InChI=1S/C13H17BrO4S2/c1-10-2-4-13(5-3-10)20(17,18)9-12-8-19(15,16)7-11(12)6-14/h2-5,11-12H,6-9H2,1H3/t11-,12+/m0/s1
InChIKey JOXKSOSBQMESSX-NWDGAFQWSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2008)
Molecular Weight 381.300 g/mol
Source File Reference MHKO18875