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3-Phenyl-4-(p-tolylsulfonyl)butan-2-ol

View entire compound with spectra: 1 MS (GC)

3-Phenyl-4-(p-tolylsulfonyl)butan-2-ol
SpectraBase Compound ID 3it3iYUXKyw
InChI InChI=1S/C17H20O3S/c1-13-8-10-16(11-9-13)21(19,20)12-17(14(2)18)15-6-4-3-5-7-15/h3-11,14,17-18H,12H2,1-2H3
InChIKey AXKSXISWWDRMSZ-UHFFFAOYSA-N
Mol Weight 304.4 g/mol
Molecular Formula C17H20O3S
Exact Mass 304.113316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IkWu7oeoqOi
Name 3-Phenyl-4-(p-tolylsulfonyl)butan-2-ol
CAS Registry Number 129665-72-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20O3S
InChI InChI=1S/C17H20O3S/c1-13-8-10-16(11-9-13)21(19,20)12-17(14(2)18)15-6-4-3-5-7-15/h3-11,14,17-18H,12H2,1-2H3
InChIKey AXKSXISWWDRMSZ-UHFFFAOYSA-N
Molecular Weight 304.404 g/mol
SMILES OC(C(CS(c1ccc(cc1)C)(=O)=O)c1ccccc1)C
SPLASH splash10-0udi-6900000000-bdc0f71e8372087a6047
Source of Spectrum F-46-3999-6
Synonyms 3-Phenyl-4-tosyl-butan-2-ol 4-(4-Methylphenyl)sulfonyl-3-phenyl-butan-2-ol 4-(4-Methylphenyl)sulfonyl-3-phenyl-2-butanol
Wiley ID 1306431