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2',4'-Difluoro-2-(pentylthio)acetophenone

View entire compound with spectra: 1 MS (GC)

2',4'-Difluoro-2-(pentylthio)acetophenone
SpectraBase Compound ID CMjrIBVcVML
InChI InChI=1S/C13H16F2OS/c1-2-3-4-7-17-9-13(16)11-6-5-10(14)8-12(11)15/h5-6,8H,2-4,7,9H2,1H3
InChIKey XLOIAGCRMOIKNS-UHFFFAOYSA-N
Mol Weight 258.33 g/mol
Molecular Formula C13H16F2OS
Exact Mass 258.088993 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EaS05BKNiKP
Name 2',4'-Difluoro-2-(pentylthio)acetophenone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16F2OS
InChI InChI=1S/C13H16F2OS/c1-2-3-4-7-17-9-13(16)11-6-5-10(14)8-12(11)15/h5-6,8H,2-4,7,9H2,1H3
InChIKey XLOIAGCRMOIKNS-UHFFFAOYSA-N
Molecular Weight 258.327 g/mol
SMILES c1(c(cc(cc1)F)F)C(=O)CSCCCCC
SPLASH splash10-0006-0920000000-74788a92d55930a9b9f7
Source of Spectrum E2-49-176-5
Synonyms 1-(2,4-difluorophenyl)-2-(pentylsulfanyl)ethanone 1-(2,4-difluorophenyl)-2-(pentylthio)ethanone 1-(2,4-difluorophenyl)-2-pentylsulfanylethanone 1-(2,4-difluorophenyl)-2-pentylsulfanyl-ethanone 1-[2,4-bis(fluoranyl)phenyl]-2-pentylsulfanyl-ethanone
Wiley ID 1555550