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(E)-5-(METHYLTHIO)-5-[(PARA-TOLYL)-SULFONYL]-4-PENTENYLMETHANESULFONATE
SpectraBase Compound ID 1wRg4gobhIy
InChI InChI=1S/C14H20O5S3/c1-12-7-9-13(10-8-12)22(17,18)14(20-2)6-4-5-11-19-21(3,15)16/h6-10H,4-5,11H2,1-3H3/b14-6+
InChIKey YXVPAMDZEBFSNA-MKMNVTDBSA-N
Mol Weight 364.49 g/mol
Molecular Formula C14H20O5S3
Exact Mass 364.047287 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CpdNZLYBfBn
Name (E)-5-(METHYLTHIO)-5-[(PARA-TOLYL)-SULFONYL]-4-PENTENYLMETHANESULFONATE
Compound Number 9A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H20O5S3
InChI InChI=1S/C14H20O5S3/c1-12-7-9-13(10-8-12)22(17,18)14(20-2)6-4-5-11-19-21(3,15)16/h6-10H,4-5,11H2,1-3H3/b14-6+
InChIKey YXVPAMDZEBFSNA-MKMNVTDBSA-N
Literature Reference Author J.K.GALLOS,C.C.DELLIOS
Literature Reference Citation J.HETCYCL.CHEM.,38,579(2001)
Literature Reference DOI 10.1002/jhet.5570380304
Molecular Weight 364.490 g/mol
Solvent CDCl3
Source File Reference UWLU21198