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2-Pentanone, 3-(phenylthio)-
SpectraBase Compound ID 2dy3GntBH1Z
InChI InChI=1S/C11H14OS/c1-3-11(9(2)12)13-10-7-5-4-6-8-10/h4-8,11H,3H2,1-2H3
InChIKey IVLIQGGZCYOJDE-UHFFFAOYSA-N
Mol Weight 194.29 g/mol
Molecular Formula C11H14OS
Exact Mass 194.076536 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KM1Hm0BIKdy
Name 2-Pentanone, 3-(phenylthio)-
Alternate Name(s) 3-(Phenylthio)pentan-2-one 3-(Phenylthio)-2-pentanone
CAS Registry Number 62870-22-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14OS
InChI InChI=1S/C11H14OS/c1-3-11(9(2)12)13-10-7-5-4-6-8-10/h4-8,11H,3H2,1-2H3
InChIKey IVLIQGGZCYOJDE-UHFFFAOYSA-N
Molecular Weight 194.292 g/mol
SMILES C(Sc1ccccc1)(C(=O)C)CC
SPLASH splash10-0f6x-4900000000-a7b3c522845a3d52249b
Source of Spectrum KC-1977-2283-0
Wiley ID 1190553