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4-Acetoxy-2-(phenylthio)butanal

View entire compound with spectra: 1 MS (GC)

4-Acetoxy-2-(phenylthio)butanal
SpectraBase Compound ID K9dCT9eRjlu
InChI InChI=1S/C12H14O3S/c1-10(14)15-8-7-12(9-13)16-11-5-3-2-4-6-11/h2-6,9,12H,7-8H2,1H3
InChIKey BRKZUFJOZATMET-UHFFFAOYSA-N
Mol Weight 238.3 g/mol
Molecular Formula C12H14O3S
Exact Mass 238.066365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HneeRQAdn1Z
Name 4-Acetoxy-2-(phenylthio)butanal
Alternate Name(s) 4-Oxo-3-(phenylsulfanyl)butyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O3S
InChI InChI=1S/C12H14O3S/c1-10(14)15-8-7-12(9-13)16-11-5-3-2-4-6-11/h2-6,9,12H,7-8H2,1H3
InChIKey BRKZUFJOZATMET-UHFFFAOYSA-N
Molecular Weight 238.301 g/mol
SMILES C(=O)(OCCC(Sc1ccccc1)C=O)C
SPLASH splash10-004j-0900000000-b54ee5e7f5815fc6602d
Source of Spectrum J-58-4864-14
Wiley ID 1240251