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S-[(2E),(6E)]-2,6-DIMETHYL-8-(PHENYLSULFONYL)-OCTA-2,6-DIEN-1-YL-ETHANETHIOATE
SpectraBase Compound ID K7ZoX4iDOxc
InChI InChI=1S/C18H24O3S2/c1-15(8-7-9-16(2)14-22-17(3)19)12-13-23(20,21)18-10-5-4-6-11-18/h4-6,9-12H,7-8,13-14H2,1-3H3/b15-12+,16-9+
InChIKey JRRYGGIIBMZUPT-YZNWVECCSA-N
Mol Weight 352.51 g/mol
Molecular Formula C18H24O3S2
Exact Mass 352.116687 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AHeTB2pVDl7
Name S-[(2E),(6E)]-2,6-DIMETHYL-8-(PHENYLSULFONYL)-OCTA-2,6-DIEN-1-YL-ETHANETHIOATE
Compound Number 27
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H24O3S2
InChI InChI=1S/C18H24O3S2/c1-15(8-7-9-16(2)14-22-17(3)19)12-13-23(20,21)18-10-5-4-6-11-18/h4-6,9-12H,7-8,13-14H2,1-3H3/b15-12+,16-9+
InChIKey JRRYGGIIBMZUPT-YZNWVECCSA-N
Literature Reference Author S.COMBEMALE,J.N.ASSAM-EVOUNG,S.HOUAIDJI,R.BIBI,V.BARRAGAN-MO NTERO
Literature Reference Citation MOLECULES,19,1120(2014)
Literature Reference DOI 10.3390/molecules19011120
Molecular Weight 352.507 g/mol
Solvent CDCl3
Source File Reference UWBT14310