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(threo)-3-Phenylthio-1-tosyl-2-butanol
SpectraBase Compound ID 3L4yzL8Xswf
InChI InChI=1S/C17H20O3S2/c1-13-8-10-16(11-9-13)22(19,20)12-17(18)14(2)21-15-6-4-3-5-7-15/h3-11,14,17-18H,12H2,1-2H3/t14-,17+/m1/s1
InChIKey MKERSQZTNZQRIY-PBHICJAKSA-N
Mol Weight 336.46 g/mol
Molecular Formula C17H20O3S2
Exact Mass 336.085387 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9xygNtIruCf
Name (threo)-3-Phenylthio-1-tosyl-2-butanol
Alternate Name(s) (2S,3R)-1-[(4-methylphenyl)sulfonyl]-3-(phenylsulfanyl)-2-butanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20O3S2
InChI InChI=1S/C17H20O3S2/c1-13-8-10-16(11-9-13)22(19,20)12-17(18)14(2)21-15-6-4-3-5-7-15/h3-11,14,17-18H,12H2,1-2H3/t14-,17+/m1/s1
InChIKey MKERSQZTNZQRIY-PBHICJAKSA-N
Molecular Weight 336.464 g/mol
SMILES O[C@@](CS(c1ccc(cc1)C)(=O)=O)([C@](Sc1ccccc1)(C)[H])[H]
SPLASH splash10-000i-2900000000-bd292cd15229277696b8
Source of Spectrum F-47-5200-2
Wiley ID 1332225