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(2S*,3R*)-2-Methyl-1-phenylthio-3-hexanol acetatel
SpectraBase Compound ID 46HIsqqnzg8
InChI InChI=1S/C15H22O2S/c1-4-8-15(17-13(3)16)12(2)11-18-14-9-6-5-7-10-14/h5-7,9-10,12,15H,4,8,11H2,1-3H3/t12-,15-/m1/s1
InChIKey UTMQIVJZNQIXCJ-IUODEOHRSA-N
Mol Weight 266.4 g/mol
Molecular Formula C15H22O2S
Exact Mass 266.134051 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7NXgDj9CN7H
Name (2S*,3R*)-2-Methyl-1-phenylthio-3-hexanol acetatel
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O2S
InChI InChI=1S/C15H22O2S/c1-4-8-15(17-13(3)16)12(2)11-18-14-9-6-5-7-10-14/h5-7,9-10,12,15H,4,8,11H2,1-3H3/t12-,15-/m1/s1
InChIKey UTMQIVJZNQIXCJ-IUODEOHRSA-N
Molecular Weight 266.399 g/mol
SMILES C(O[C@@]([C@@](CSc1ccccc1)(C)[H])(CCC)[H])(=O)C
SPLASH splash10-052f-9200000000-634f11ab7adda5fa8081
Source of Spectrum AJ-69-2102-2
Synonyms (1R)-1-[(1S)-1-methyl-2-(phenylsulfanyl)ethyl]butyl acetate (2R*,3S*)-2-Methyl-1-phenylthio-3-hexanol acetate
Wiley ID 773860