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1-[3-[(trifluoromethyl)thio]phenyl]ethanone
SpectraBase Compound ID 2sSOn8xNm7n
InChI InChI=1S/C9H7F3OS/c1-6(13)7-3-2-4-8(5-7)14-9(10,11)12/h2-5H,1H3
InChIKey UKKYMJZZMADIAV-UHFFFAOYSA-N
Mol Weight 220.21 g/mol
Molecular Formula C9H7F3OS
Exact Mass 220.016971 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gswi6Uyi6em
Name 1-[3-[(trifluoromethyl)thio]phenyl]ethanone
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 220.016970507 u
Formula C9H7F3OS
GC Column HP-5 (30 m x 320 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 300oC
InChI InChI=1S/C9H7F3OS/c1-6(13)7-3-2-4-8(5-7)14-9(10,11)12/h2-5H,1H3
InChIKey UKKYMJZZMADIAV-UHFFFAOYSA-N
Instrument Name Varian Saturn 2100 T
Ionization Type EI
Literature Reference DOI 10.1002/chem.201503915
Molecular Weight 220.209 g/mol
Quality 344
Reported Formula C9H7F3OS
SMILES C1(=CC(=CC=C1)SC(F)(F)F)C(C)=O
SPLASH splash10-0a4i-1190000000-2b62d12228a34207c728
Source of Spectrum QE-21-SM26-2g (DOI: 10.1002/chem.201503915)
Wiley ID 1907360