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anti,syn and syn,syn-(2SR,3RS,4SR)/2SR,3RS,4RS)-S-Phenyl 3-hydroxy-2,4,7-trimethyl-4-phenylsulfanyloctanethioate
SpectraBase Compound ID 2O81BZAwKSC
InChI InChI=1S/C23H30O2S2/c1-17(2)15-16-23(4,27-20-13-9-6-10-14-20)21(24)18(3)22(25)26-19-11-7-5-8-12-19/h5-14,17-18,21,24H,15-16H2,1-4H3/t18-,21-,23+/m0/s1
InChIKey BJLHYLAYNSRUFE-AVCGJXAMSA-N
Mol Weight 402.61 g/mol
Molecular Formula C23H30O2S2
Exact Mass 402.168723 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CWXcf3TldyE
Name anti,syn and syn,syn-(2SR,3RS,4SR)/2SR,3RS,4RS)-S-Phenyl 3-hydroxy-2,4,7-trimethyl-4-phenylsulfanyloctanethioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H30O2S2
InChI InChI=1S/C23H30O2S2/c1-17(2)15-16-23(4,27-20-13-9-6-10-14-20)21(24)18(3)22(25)26-19-11-7-5-8-12-19/h5-14,17-18,21,24H,15-16H2,1-4H3/t18-,21-,23+/m0/s1
InChIKey BJLHYLAYNSRUFE-AVCGJXAMSA-N
Molecular Weight 402.611 g/mol
SMILES O[C@]([C@](Sc1ccccc1)(CCC(C)C)C)([C@@](C(Sc1ccccc1)=O)(C)[H])[H]
SPLASH splash10-0bvl-0940000000-3945d36745307fc999ad
Source of Spectrum KC-0-542-39
Synonyms anti,syn-(2S,3S,4R)-S-Phenyl 3-hydroxy-2,4,7-trimethyl-4-phenylsulfanyl-octanethioate S-phenyl (2S,3S,4R)-3-hydroxy-2,4,7-trimethyl-4-phenylsulfanyloctanethioate S-phenyl (2S,3S,4R)-3-hydroxy-2,4,7-trimethyl-4-phenylsulfanyl-octanethioate S-phenyl (2S,3S,4R)-2,4,7-trimethyl-3-oxidanyl-4-phenylsulfanyl-octanethioate
Wiley ID 830020