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1-Chloro-2-methyl-4-phenyl-1-((S)-p-tolylsulfinyl)-1-butane-2-ol
SpectraBase Compound ID AC4XqAhoVIn
InChI InChI=1S/C18H21ClO2S/c1-14-8-10-16(11-9-14)22(21)17(19)18(2,20)13-12-15-6-4-3-5-7-15/h3-11,17,20H,12-13H2,1-2H3
InChIKey HRMIHVHZZIJSQN-UHFFFAOYSA-N
Mol Weight 336.88 g/mol
Molecular Formula C18H21ClO2S
Exact Mass 336.095079 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LwxtXJ7m55H
Name 1-Chloro-2-methyl-4-phenyl-1-((S)-p-tolylsulfinyl)-1-butane-2-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21ClO2S
InChI InChI=1S/C18H21ClO2S/c1-14-8-10-16(11-9-14)22(21)17(19)18(2,20)13-12-15-6-4-3-5-7-15/h3-11,17,20H,12-13H2,1-2H3
InChIKey HRMIHVHZZIJSQN-UHFFFAOYSA-N
Molecular Weight 336.877 g/mol
SMILES OC(C([S@](c1ccc(C)cc1)=O)Cl)(CCc1ccccc1)C
SPLASH splash10-0006-6900000000-d15d4401b5ea5b3a67c7
Source of Spectrum KD-16-669-8
Synonyms 1-Chloro-2-methyl-1-[(4-methylphenyl)sulfinyl]-4-phenyl-2-butanol 1-Chloro-2-methyl-4-phenyl-1-(p-tolylsulfinyl)-1-butane-2-ol
Wiley ID 1637429