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(2S,3R,4S)-4-Diphenylphosphinoyl-2-(1,1-dimethylethylsulfanyl)-5-methylhexane-1,3-diol
SpectraBase Compound ID 1tGMrcpZJ4I
InChI InChI=1S/C23H33O3PS/c1-17(2)22(21(25)20(16-24)28-23(3,4)5)27(26,18-12-8-6-9-13-18)19-14-10-7-11-15-19/h6-15,17,20-22,24-25H,16H2,1-5H3/t20-,21-,22-/m0/s1
InChIKey LBTADCRYSZIHMZ-FKBYEOEOSA-N
Mol Weight 420.5 g/mol
Molecular Formula C23H33O3PS
Exact Mass 420.188803 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HyiQj7k28dx
Name (2S,3R,4S)-4-Diphenylphosphinoyl-2-(1,1-dimethylethylsulfanyl)-5-methylhexane-1,3-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H33O3PS
InChI InChI=1S/C23H33O3PS/c1-17(2)22(21(25)20(16-24)28-23(3,4)5)27(26,18-12-8-6-9-13-18)19-14-10-7-11-15-19/h6-15,17,20-22,24-25H,16H2,1-5H3/t20-,21-,22-/m0/s1
InChIKey LBTADCRYSZIHMZ-FKBYEOEOSA-N
Molecular Weight 420.548 g/mol
SMILES OC[C@@]([C@@]([C@@](P(=O)(c1ccccc1)c1ccccc1)(C(C)C)[H])(O)[H])(SC(C)(C)C)[H]
SPLASH splash10-0udr-0090000000-52028affe2a8d9820920
Source of Spectrum KC-0-1922-20
Synonyms (2S,3R,4S)-2-(tert-butylthio)-4-diphenylphosphoryl-5-methylhexane-1,3-diol (2S,3R,4S)-2-tert-butylsulfanyl-4-diphenylphosphoryl-5-methylhexane-1,3-diol (2S,3R,4S)-2-tert-butylsulfanyl-4-diphenylphosphoryl-5-methyl-hexane-1,3-diol
Wiley ID 784209