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3-Phenylsulphinylpentan-2-one
SpectraBase Compound ID 1akjTQlKCKq
InChI InChI=1S/C11H14O2S/c1-3-11(9(2)12)14(13)10-7-5-4-6-8-10/h4-8,11H,3H2,1-2H3
InChIKey DXXCZUHAYITMSB-UHFFFAOYSA-N
Mol Weight 210.29 g/mol
Molecular Formula C11H14O2S
Exact Mass 210.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6eaIp3wcXc2
Name 3-Phenylsulphinylpentan-2-one
CAS Registry Number 83182-37-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O2S
InChI InChI=1S/C11H14O2S/c1-3-11(9(2)12)14(13)10-7-5-4-6-8-10/h4-8,11H,3H2,1-2H3
InChIKey DXXCZUHAYITMSB-UHFFFAOYSA-N
Molecular Weight 210.291 g/mol
SMILES C(S(=O)c1ccccc1)(C(=O)C)CC
SPLASH splash10-01t9-0900000000-00709696cc2c40ae93f5
Source of Spectrum KC-1986-1942-19
Synonyms 3-(Phenylsulfinyl)-2-pentanone
Wiley ID 1208831