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2-[(Ethylsulfanyl)methyl]-3-methyl-1-phenylbutane-1,2-diol
SpectraBase Compound ID 5n0XGhZEuZs
InChI InChI=1S/C14H22O2S/c1-4-17-10-14(16,11(2)3)13(15)12-8-6-5-7-9-12/h5-9,11,13,15-16H,4,10H2,1-3H3
InChIKey JBJWBCBELICDBB-UHFFFAOYSA-N
Mol Weight 254.39 g/mol
Molecular Formula C14H22O2S
Exact Mass 254.134051 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9pL93U6wjDE
Name 2-[(Ethylsulfanyl)methyl]-3-methyl-1-phenylbutane-1,2-diol
Alternate Name(s) 2-[(ethylsulfanyl)methyl]-3-methyl-1-phenyl-1,2-butanediol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O2S
InChI InChI=1S/C14H22O2S/c1-4-17-10-14(16,11(2)3)13(15)12-8-6-5-7-9-12/h5-9,11,13,15-16H,4,10H2,1-3H3
InChIKey JBJWBCBELICDBB-UHFFFAOYSA-N
Molecular Weight 254.388 g/mol
SMILES OC(C(O)c1ccccc1)(C(C)C)CSCC
SPLASH splash10-004j-9500000000-c6d7cba2d3bae7e801f7
Source of Spectrum U1-1998-2167-22
Wiley ID 751872