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Benzyl 5,5-Dimethoxypentyl-2-yl Sulfide
SpectraBase Compound ID 9aFfhn1t6f3
InChI InChI=1S/C14H22O2S/c1-12(9-10-14(15-2)16-3)17-11-13-7-5-4-6-8-13/h4-8,12,14H,9-11H2,1-3H3
InChIKey HMJYHFSQCFDWHI-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 CfYS2XpsmFK
Name Benzyl 5,5-Dimethoxypentyl-2-yl Sulfide
Alternate Name(s) {[(4,4-dimethoxy-1-methylbutyl)sulfanyl]methyl}benzene
CAS Registry Number 140927-89-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O2S
InChI InChI=1S/C14H22O2S/c1-12(9-10-14(15-2)16-3)17-11-13-7-5-4-6-8-13/h4-8,12,14H,9-11H2,1-3H3
InChIKey HMJYHFSQCFDWHI-UHFFFAOYSA-N
Molecular Weight 254.388 g/mol
SMILES C(SC(CCC(OC)OC)C)c1ccccc1
SPLASH splash10-0a4m-2900000000-a1bb3dea509d3e0fc060
Source of Spectrum J-57-3487-6
Wiley ID 1257643