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rac-(1R*,5S*,7aR*)1-[(1R*)-1-Hydroxymethyl-5-methylhex-5-enyl]-7a-methyl-4-(phenylthio)-2,3,5,6,7,7a-hexahydro-1H-inden-5-ol
SpectraBase Compound ID G9MlwC4Gfre
InChI InChI=1S/C24H34O2S/c1-17(2)8-7-9-18(16-25)20-12-13-21-23(22(26)14-15-24(20,21)3)27-19-10-5-4-6-11-19/h4-6,10-11,18,20,22,25-26H,1,7-9,12-16H2,2-3H3/t18-,20+,22-,24+/m0/s1
InChIKey OWDZHWWQYBBBND-PJXYCGMHSA-N
Mol Weight 386.6 g/mol
Molecular Formula C24H34O2S
Exact Mass 386.227952 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6mssO0DxLnK
Name rac-(1R*,5S*,7aR*)1-[(1R*)-1-Hydroxymethyl-5-methylhex-5-enyl]-7a-methyl-4-(phenylthio)-2,3,5,6,7,7a-hexahydro-1H-inden-5-ol
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Formula C24H34O2S
InChI InChI=1S/C24H34O2S/c1-17(2)8-7-9-18(16-25)20-12-13-21-23(22(26)14-15-24(20,21)3)27-19-10-5-4-6-11-19/h4-6,10-11,18,20,22,25-26H,1,7-9,12-16H2,2-3H3/t18-,20+,22-,24+/m0/s1
InChIKey OWDZHWWQYBBBND-PJXYCGMHSA-N
Molecular Weight 386.594 g/mol
SMILES OC[C@@]([C@@]1([C@@]2(C(=C([C@](CC2)(O)[H])Sc2ccccc2)CC1)C)[H])(CCCC(=C)C)[H]
SPLASH splash10-0a4i-9808000000-80a1d634e57dd24e18f5
Source of Spectrum U1-2002-2733-27
Synonyms (1R,5S,7aR)-1-[(2R)-1-hydroxy-6-methylhept-6-en-2-yl]-7a-methyl-4-(phenylthio)-1,2,3,5,6,7-hexahydroinden-5-ol (1R,5S,7aR)-1-[(2R)-1-hydroxy-6-methylhept-6-en-2-yl]-7a-methyl-4-phenylsulfanyl-1,2,3,5,6,7-hexahydroinden-5-ol (1R,5S,7aR)-1-[(1R)-1-(hydroxymethyl)-5-methyl-hex-5-enyl]-7a-methyl-4-phenylsulfanyl-1,2,3,5,6,7-hexahydroinden-5-ol (1R,5S,7aR)-7a-methyl-1-[(2R)-6-methyl-1-oxidanyl-hept-6-en-2-yl]-4-phenylsulfanyl-1,2,3,5,6,7-hexahydroinden-5-ol
Wiley ID 1522871