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2-Butanol, 3-[(phenylmethyl)sulfonyl]-, [R-(R*,S*)]-
SpectraBase Compound ID EsaGJGIsNwN
InChI InChI=1S/C11H16O3S/c1-9(12)10(2)15(13,14)8-11-6-4-3-5-7-11/h3-7,9-10,12H,8H2,1-2H3/t9-,10+/m0/s1
InChIKey DIWOUZKPNODNEZ-VHSXEESVSA-N
Mol Weight 228.31 g/mol
Molecular Formula C11H16O3S
Exact Mass 228.082016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 67SVpsfAj4k
Name 2-Butanol, 3-[(phenylmethyl)sulfonyl]-, [R-(R*,S*)]-
CAS Registry Number 69164-57-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O3S
InChI InChI=1S/C11H16O3S/c1-9(12)10(2)15(13,14)8-11-6-4-3-5-7-11/h3-7,9-10,12H,8H2,1-2H3/t9-,10+/m0/s1
InChIKey DIWOUZKPNODNEZ-VHSXEESVSA-N
Molecular Weight 228.306 g/mol
SMILES O[C@]([C@](S(Cc1ccccc1)(=O)=O)(C)[H])(C)[H]
SPLASH splash10-0002-9000000000-9d50c864221543f9f1b1
Source of Spectrum B-31-1977-0
Synonyms (2S,3R)-(+)-3-(benzylsulfonyl)butan-2-ol (2S,3R)-3-(benzylsulfonyl)-2-butanol
Wiley ID 1229357