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(2R,3S,4E)-5-BENZENESULFONYL-1-BROMO-2,3-ISOPROPYLIDENEDIOXY-PENT-4-ENE
SpectraBase Compound ID DdiVcwxUKRb
InChI InChI=1S/C14H17BrO4S/c1-14(2)18-12(13(10-15)19-14)8-9-20(16,17)11-6-4-3-5-7-11/h3-9,12-13H,10H2,1-2H3/b9-8+/t12-,13+/m0/s1
InChIKey BBXZSMQTNCLZGY-AYSSICMYSA-N
Mol Weight 361.25 g/mol
Molecular Formula C14H17BrO4S
Exact Mass 360.003093 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1om27DTKBB5
Name (2R,3S,4E)-5-BENZENESULFONYL-1-BROMO-2,3-ISOPROPYLIDENEDIOXY-PENT-4-ENE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H17BrO4S
InChI InChI=1S/C14H17BrO4S/c1-14(2)18-12(13(10-15)19-14)8-9-20(16,17)11-6-4-3-5-7-11/h3-9,12-13H,10H2,1-2H3/b9-8+/t12-,13+/m0/s1
InChIKey BBXZSMQTNCLZGY-AYSSICMYSA-N
Literature Reference Author D.DIEZ,M.T.BENEITEZ,I.S.MARCOS,N.M.GARRIDO,P.BASABE,J.G.URON ES
Literature Reference Citation MOLECULES,9,323(2004)
Literature Reference DOI 10.3390/90500323
Molecular Weight 361.251 g/mol
Solvent CDCl3
Source File Reference UWMS5961