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S-PHENYL-(9Z,12R)-12-HYDROXYOCTADEC-9-ENE-THIOATE

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S-PHENYL-(9Z,12R)-12-HYDROXYOCTADEC-9-ENE-THIOATE
SpectraBase Compound ID 6OWDlb9rH0Z
InChI InChI=1S/C24H38O2S/c1-2-3-4-12-17-22(25)18-13-9-7-5-6-8-10-16-21-24(26)27-23-19-14-11-15-20-23/h9,11,13-15,19-20,22,25H,2-8,10,12,16-18,21H2,1H3/b13-9-/t22-/m0/s1
InChIKey XVPPPTYGYYSKJA-BPRLYGGPSA-N
Mol Weight 390.6 g/mol
Molecular Formula C24H38O2S
Exact Mass 390.259252 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CDr7SlpX0y4
Name S-PHENYL-(9Z,12R)-12-HYDROXYOCTADEC-9-ENE-THIOATE
Compound Number 3C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H38O2S
InChI InChI=1S/C24H38O2S/c1-2-3-4-12-17-22(25)18-13-9-7-5-6-8-10-16-21-24(26)27-23-19-14-11-15-20-23/h9,11,13-15,19-20,22,25H,2-8,10,12,16-18,21H2,1H3/b13-9-/t22-/m0/s1
InChIKey XVPPPTYGYYSKJA-BPRLYGGPSA-N
Literature Reference Author S.GANGAL,S.SHARMA,A.RAUF
Literature Reference Citation RASAYAN.J.CHEM.,2,682(2009)
Molecular Weight 390.625 g/mol
Solvent CDCl3
Source File Reference UWLU78777