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Retinol, 9,10-dihydro-9-(phenylsulfonyl)-
SpectraBase Compound ID 1V94lVnPeHG
InChI InChI=1S/C26H36O3S/c1-21(16-20-27)11-9-18-26(5,30(28,29)23-13-7-6-8-14-23)19-15-24-22(2)12-10-17-25(24,3)4/h6-9,11,13-16,19,27H,10,12,17-18,20H2,1-5H3/b11-9-,19-15-,21-16-
InChIKey QVLRNNPIHSZWTQ-OASOAWLSSA-N
Mol Weight 428.6 g/mol
Molecular Formula C26H36O3S
Exact Mass 428.238516 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 24euwTVFx6a
Name Retinol, 9,10-dihydro-9-(phenylsulfonyl)-
CAS Registry Number 59385-11-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H36O3S
InChI InChI=1S/C26H36O3S/c1-21(16-20-27)11-9-18-26(5,30(28,29)23-13-7-6-8-14-23)19-15-24-22(2)12-10-17-25(24,3)4/h6-9,11,13-16,19,27H,10,12,17-18,20H2,1-5H3/b11-9-,19-15-,21-16-
InChIKey QVLRNNPIHSZWTQ-OASOAWLSSA-N
Molecular Weight 428.631 g/mol
SMILES OC\C=C/(\C=C/CC(S(=O)(=O)c1ccccc1)(\C=C/C1=C(CCCC1(C)C)C)C)C
SPLASH splash10-004i-9030000000-1d77cf31da72141ce632
Source of Spectrum H-59-404-13
Synonyms (7cis,11cis,13cis)-9-(phenylsulfonyl)-9,10-dihydroretinol all-E-3,7-dimethyl-7-(phenylsulfonyl)-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,8-nonatrien-1-ol
Wiley ID 1380794