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3,3-Dimethyl-1-[(phenylsulfanyl)carbonyl]butyl acetate
SpectraBase Compound ID IfFpKF16Hq1
InChI InChI=1S/C15H20O3S/c1-11(16)18-13(10-15(2,3)4)14(17)19-12-8-6-5-7-9-12/h5-9,13H,10H2,1-4H3
InChIKey UBFVVSIXVRIDRL-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 IRtKDtWGy1H
Name 3,3-Dimethyl-1-[(phenylsulfanyl)carbonyl]butyl acetate
CAS Registry Number 65302-92-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O3S
InChI InChI=1S/C15H20O3S/c1-11(16)18-13(10-15(2,3)4)14(17)19-12-8-6-5-7-9-12/h5-9,13H,10H2,1-4H3
InChIKey UBFVVSIXVRIDRL-UHFFFAOYSA-N
Molecular Weight 280.382 g/mol
SMILES CC(=O)OC(CC(C)(C)C)C(=O)Sc1ccccc1
SPLASH splash10-0006-9100000000-ce8a5cdc2e636c12354e
Source of Spectrum W5-1989-9485-1
Synonyms (4,4-dimethyl-1-oxidanylidene-1-phenylsulfanyl-pentan-2-yl) ethanoate (4,4-dimethyl-1-oxo-1-phenylsulfanylpentan-2-yl) acetate 2-Acetoxy-3-tert-butyl-S-phenylpropanethioate Acetic acid [4,4-dimethyl-1-oxo-1-(phenylthio)pentan-2-yl] ester (3,3-dimethyl-1-phenylsulfanylcarbonyl-butyl) acetate
Wiley ID 1283753