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3-Methoxy-4-(methylthio)-1-phenyl-1-pentanone
SpectraBase Compound ID J6G6CHDi3sY
InChI InChI=1S/C13H18O2S/c1-10(16-3)13(15-2)9-12(14)11-7-5-4-6-8-11/h4-8,10,13H,9H2,1-3H3
InChIKey BAVGISCGWHWNDQ-UHFFFAOYSA-N
Mol Weight 238.34 g/mol
Molecular Formula C13H18O2S
Exact Mass 238.102751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Aap9kN91Wry
Name 3-Methoxy-4-(methylthio)-1-phenyl-1-pentanone
Alternate Name(s) 2,5-Dideoxy-3-O-methyl-4-S-methyl-1-phenyl-4-thiopentose
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O2S
InChI InChI=1S/C13H18O2S/c1-10(16-3)13(15-2)9-12(14)11-7-5-4-6-8-11/h4-8,10,13H,9H2,1-3H3
InChIKey BAVGISCGWHWNDQ-UHFFFAOYSA-N
Molecular Weight 238.345 g/mol
SMILES C(C(=O)c1ccccc1)C(C(SC)C)OC
SPLASH splash10-0a4i-3920000000-3ec39701cabde1218177
Source of Spectrum J-58-585-3
Wiley ID 1240442