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1-(p-tolylthio)-3-methyl-2-oxobutyl acetate
SpectraBase Compound ID KvsLR7mjAnQ
InChI InChI=1S/C14H18O3S/c1-9(2)13(16)14(17-11(4)15)18-12-7-5-10(3)6-8-12/h5-9,14H,1-4H3
InChIKey FTVGJRCQAXIIJS-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 8pVEv74R5hg
Name 1-(p-tolylthio)-3-methyl-2-oxobutyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O3S
InChI InChI=1S/C14H18O3S/c1-9(2)13(16)14(17-11(4)15)18-12-7-5-10(3)6-8-12/h5-9,14H,1-4H3
InChIKey FTVGJRCQAXIIJS-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201000376
Molecular Weight 266.355 g/mol
SMILES C(C)(=O)OC(C(C(C)C)=O)Sc1ccc(cc1)C
SPLASH splash10-0uk9-2900000000-e041eece2a4f3af04ae7
Source of Spectrum ASC-352-2955/SM3-1k
Synonyms 3-Methyl-2-oxo-1-(p-tolylthio)butyl acetate
Wiley ID 1764078