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(2S,S(S))-2-[(1R)-1-PHENYL-1-HYDROXYETHYL]-1,3-BEZOXATHIOL-3-(2H)-OXIDE
SpectraBase Compound ID ClrZP320RrO
InChI InChI=1S/C15H14O3S/c1-15(16,11-7-3-2-4-8-11)14-18-12-9-5-6-10-13(12)19(14)17/h2-10,14,16H,1H3/t14-,15+,19?/m0/s1
InChIKey IAYHJZSPOUROCE-FPHLKLNRSA-N
Mol Weight 274.33 g/mol
Molecular Formula C15H14O3S
Exact Mass 274.066365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IW6H9AYEVWK
Name [2S]-2-[(1R)-1'-Phenyl-1'-hydroxyethyl]-1,3-benzoxathiol-3(2H)-oxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H14O3S
InChI InChI=1S/C15H14O3S/c1-15(16,11-7-3-2-4-8-11)14-18-12-9-5-6-10-13(12)19(14)17/h2-10,14,16H,1H3/t14-,15+,19?/m0/s1
InChIKey IAYHJZSPOUROCE-FPHLKLNRSA-N
Molecular Weight 274.334 g/mol
SMILES O[C@@]([C@@]1(S(c2ccccc2O1)=O)[H])(c1ccccc1)C
SPLASH splash10-053f-5900000000-2ba52c4f128ffbc0515a
Source of Spectrum Y-40-984-4
Synonyms (1R)-1-[(2S)-3-keto-1,3-benzoxathiol-2-yl]-1-phenyl-ethanol (1R)-1-[(2S)-3-oxidanylidene-1,3-benzoxathiol-2-yl]-1-phenyl-ethanol (1R)-1-[(2S)-3-oxido-1,3-benzoxathiol-2-yl]-1-phenylethanol (1R)-1-[(2S)-3-oxo-1,3-benzoxathiol-2-yl]-1-phenyl-ethanol (1R)-1-[(2S)-3-oxo-1,3$l^{4}-benzoxathiol-2-yl]-1-phenylethanol (1R)-1-[(2S)-3-oxo-1,3$l^{4}-benzoxathiol-2-yl]-1-phenyl-ethanol (1R)-1-[(2S)-3-oxidanylidene-1,3$l^{4}-benzoxathiol-2-yl]-1-phenyl-ethanol
Wiley ID 1529015