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(1S,2S)-4-chloro-1-phenyl-2-(phenylsulfonyl)butan-1-ol
SpectraBase Compound ID 9zEPHJyKfFk
InChI InChI=1S/C16H17ClO3S/c17-12-11-15(16(18)13-7-3-1-4-8-13)21(19,20)14-9-5-2-6-10-14/h1-10,15-16,18H,11-12H2/t15-,16-/m0/s1
InChIKey YXGQPIGCFQJMOY-HOTGVXAUSA-N
Mol Weight 324.82 g/mol
Molecular Formula C16H17ClO3S
Exact Mass 324.058693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4xYS1hO3IsN
Name (1S,2S)-4-chloro-1-phenyl-2-(phenylsulfonyl)butan-1-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17ClO3S
InChI InChI=1S/C16H17ClO3S/c17-12-11-15(16(18)13-7-3-1-4-8-13)21(19,20)14-9-5-2-6-10-14/h1-10,15-16,18H,11-12H2/t15-,16-/m0/s1
InChIKey YXGQPIGCFQJMOY-HOTGVXAUSA-N
Literature Reference DOI 10.1021/jo1002196
Molecular Weight 324.822 g/mol
SMILES O[C@@](c1ccccc1)([C@@](S(c1ccccc1)(=O)=O)(CCCl)[H])[H]
SPLASH splash10-067i-0910000000-0e7700c7fa7276b0c4ad
Source of Spectrum J-75-3251/SMS103-arb31
Wiley ID 1751527