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3,3-Diethoxy-1-(phenylthio)-2-butanone
SpectraBase Compound ID Fudl228cipX
InChI InChI=1S/C14H20O3S/c1-4-16-14(3,17-5-2)13(15)11-18-12-9-7-6-8-10-12/h6-10H,4-5,11H2,1-3H3
InChIKey MPUJBEBZWCXOFL-UHFFFAOYSA-N
Mol Weight 268.37 g/mol
Molecular Formula C14H20O3S
Exact Mass 268.113316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D6iAmBiJxu1
Name 3,3-Diethoxy-1-(phenylthio)-2-butanone
Alternate Name(s) 3,3-Diethoxy-1-(phenylthio)butan-2-one 3,3-Diethoxy-1-phenylsulfanyl-butan-2-one
CAS Registry Number 111731-07-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O3S
InChI InChI=1S/C14H20O3S/c1-4-16-14(3,17-5-2)13(15)11-18-12-9-7-6-8-10-12/h6-10H,4-5,11H2,1-3H3
InChIKey MPUJBEBZWCXOFL-UHFFFAOYSA-N
Molecular Weight 268.371 g/mol
SMILES C(C(OCC)(OCC)C)(CSc1ccccc1)=O
SPLASH splash10-02tc-9500000000-37228d7625f60c631cc2
Source of Spectrum F-43-2482-4
Wiley ID 1271972