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(2S)-2-[(1S,3aS,4S,7aS)-4-Benzenesulfony-7a-methyl-octahydroinden-1-yl]-6-methylheptan-1-ol
SpectraBase Compound ID HwqDuxIhu3o
InChI InChI=1S/C24H38O3S/c1-18(2)9-7-10-19(17-25)21-14-15-22-23(13-8-16-24(21,22)3)28(26,27)20-11-5-4-6-12-20/h4-6,11-12,18-19,21-23,25H,7-10,13-17H2,1-3H3/t19-,21+,22-,23+,24+/m1/s1
InChIKey GAOIDPJRTQWUNL-NZURDFQBSA-N
Mol Weight 406.6 g/mol
Molecular Formula C24H38O3S
Exact Mass 406.254166 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9vrWrd8meMD
Name (2S)-2-[(1S,3aS,4S,7aS)-4-Benzenesulfony-7a-methyl-octahydroinden-1-yl]-6-methylheptan-1-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H38O3S
InChI InChI=1S/C24H38O3S/c1-18(2)9-7-10-19(17-25)21-14-15-22-23(13-8-16-24(21,22)3)28(26,27)20-11-5-4-6-12-20/h4-6,11-12,18-19,21-23,25H,7-10,13-17H2,1-3H3/t19-,21+,22-,23+,24+/m1/s1
InChIKey GAOIDPJRTQWUNL-NZURDFQBSA-N
Molecular Weight 406.625 g/mol
SMILES OC[C@]([C@]1([C@]2([C@@]([C@@](S(=O)(=O)c3ccccc3)(CCC2)[H])(CC1)[H])C)[H])(CCCC(C)C)[H]
SPLASH splash10-000b-6940000000-576b7db71b6a73a8f0f2
Source of Spectrum QC-10-1596-10
Wiley ID 871356