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2,2-Dimethyl-1-[(phenylsulfanyl)acetyl]propyl acetate
SpectraBase Compound ID 5po8GVdhDsO
InChI InChI=1S/C15H20O3S/c1-11(16)18-14(15(2,3)4)13(17)10-19-12-8-6-5-7-9-12/h5-9,14H,10H2,1-4H3
InChIKey YGEHLYAPLQLLME-UHFFFAOYSA-N
Mol Weight 280.38 g/mol
Molecular Formula C15H20O3S
Exact Mass 280.113316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4MojvQjk015
Name 2,2-Dimethyl-1-[(phenylsulfanyl)acetyl]propyl acetate
CAS Registry Number 65302-93-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O3S
InChI InChI=1S/C15H20O3S/c1-11(16)18-14(15(2,3)4)13(17)10-19-12-8-6-5-7-9-12/h5-9,14H,10H2,1-4H3
InChIKey YGEHLYAPLQLLME-UHFFFAOYSA-N
Molecular Weight 280.382 g/mol
SMILES CC(=O)OC(C(CSc1ccccc1)=O)C(C)(C)C
SPLASH splash10-0006-9500000000-3552e5692e4bf7a6e06c
Source of Spectrum W5-1989-9484-1
Synonyms (4,4-dimethyl-2-oxidanylidene-1-phenylsulfanyl-pentan-3-yl) ethanoate (4,4-dimethyl-2-oxo-1-phenylsulfanylpentan-3-yl) acetate 1-Acetoxy-1-tert-butyl-3-phenylthio-2-propanone Acetic acid [4,4-dimethyl-2-oxo-1-(phenylthio)pentan-3-yl] ester [2,2-dimethyl-1-(2-phenylsulfanylacetyl)propyl] acetate
Wiley ID 1283754