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3,3-Dimethyl-2-oxo-1-(phenylthio)butyl acetate

View entire compound with spectra: 1 MS (GC)

3,3-Dimethyl-2-oxo-1-(phenylthio)butyl acetate
SpectraBase Compound ID LMesjU7HLZS
InChI InChI=1S/C14H18O3S/c1-10(15)17-13(12(16)14(2,3)4)18-11-8-6-5-7-9-11/h5-9,13H,1-4H3
InChIKey MCQNLSPRSMCSGW-UHFFFAOYSA-N
Mol Weight 266.35 g/mol
Molecular Formula C14H18O3S
Exact Mass 266.097666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CcCZRoH4vMF
Name 3,3-Dimethyl-2-oxo-1-(phenylthio)butyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O3S
InChI InChI=1S/C14H18O3S/c1-10(15)17-13(12(16)14(2,3)4)18-11-8-6-5-7-9-11/h5-9,13H,1-4H3
InChIKey MCQNLSPRSMCSGW-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201000376
Molecular Weight 266.355 g/mol
SMILES C(C)(=O)OC(C(C(C)(C)C)=O)Sc1ccccc1
SPLASH splash10-053i-2910000000-3e440d5e03b8f094a6a9
Source of Spectrum ASC-352-2955/SM3-1f
Wiley ID 1764074