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4-Methyl-2-oxo-1-(phenylsulfanyl)pentyl acetate
SpectraBase Compound ID 89k8TpwRMGx
InChI InChI=1S/C14H18O3S/c1-10(2)9-13(16)14(17-11(3)15)18-12-7-5-4-6-8-12/h4-8,10,14H,9H2,1-3H3
InChIKey JOKSJRGTPKRMIQ-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 FCdHgj1NqJo
Name 4-Methyl-2-oxo-1-(phenylsulfanyl)pentyl acetate
Alternate Name(s) (4-methyl-2-oxidanylidene-1-phenylsulfanyl-pentyl) ethanoate 1-Phenylthio-1-acetoxy-3-isopropyl-2-propanone Acetic acid [4-methyl-2-oxo-1-(phenylthio)pentyl] ester (4-methyl-2-oxo-1-phenylsulfanylpentyl) acetate (4-methyl-2-oxo-1-phenylsulfanyl-pentyl) acetate
CAS Registry Number 69798-59-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O3S
InChI InChI=1S/C14H18O3S/c1-10(2)9-13(16)14(17-11(3)15)18-12-7-5-4-6-8-12/h4-8,10,14H,9H2,1-3H3
InChIKey JOKSJRGTPKRMIQ-UHFFFAOYSA-N
Molecular Weight 266.355 g/mol
SMILES CC(C)CC(C(OC(C)=O)Sc1ccccc1)=O
SPLASH splash10-0006-9300000000-036316a654223b8c35a1
Source of Spectrum W5-1989-9482-1
Wiley ID 1269806