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Benzeneethan-.beta.-d-ol, .alpha.-methyl-, 4-methylbenzenesulfonate, (R*,S*)-
SpectraBase Compound ID GxolA5TSrzC
InChI InChI=1S/C16H18O3S/c1-13-8-10-16(11-9-13)20(17,18)19-14(2)12-15-6-4-3-5-7-15/h3-11,14H,12H2,1-2H3/i12D
InChIKey HJCYASUUAOLDSA-UQBWLURTSA-N
Mol Weight 291.38 g/mol
Molecular Formula C16H172DO3S
Exact Mass 291.103942 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3zmiwsEDkVE
Name Benzeneethan-.beta.-d-ol, .alpha.-methyl-, 4-methylbenzenesulfonate, (R*,S*)-
Alternate Name(s) (1-2H1)-1-phenyl 2-tosyl propane
CAS Registry Number 80150-96-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17DO3S
InChI InChI=1S/C16H18O3S/c1-13-8-10-16(11-9-13)20(17,18)19-14(2)12-15-6-4-3-5-7-15/h3-11,14H,12H2,1-2H3/i12D
InChIKey HJCYASUUAOLDSA-UQBWLURTSA-N
Molecular Weight 291.383 g/mol
SMILES C(OS(c1ccc(cc1)C)(=O)=O)(C(c1ccccc1)[2D])C
SPLASH splash10-00kf-9500000000-c6a25735edffd3519ea2
Source of Spectrum AC-1983-183-0
Wiley ID 1293544