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[2-[(trifluoromethyl)thio]ethyl]benzene
SpectraBase Compound ID LQnkceDR3wV
InChI InChI=1S/C9H9F3S/c10-9(11,12)13-7-6-8-4-2-1-3-5-8/h1-5H,6-7H2
InChIKey OSRXXTOOTLTGKL-UHFFFAOYSA-N
Mol Weight 206.23 g/mol
Molecular Formula C9H9F3S
Exact Mass 206.037706 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IBfRGVjEDmQ
Name [2-[(trifluoromethyl)thio]ethyl]benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 206.037705953 u
Formula C9H9F3S
GC Column HP-5 (30 m x 320 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 300oC
InChI InChI=1S/C9H9F3S/c10-9(11,12)13-7-6-8-4-2-1-3-5-8/h1-5H,6-7H2
InChIKey OSRXXTOOTLTGKL-UHFFFAOYSA-N
Instrument Name Varian Saturn 2100 T
Ionization Type EI
Literature Reference DOI 10.1002/chem.201503915
Molecular Weight 206.226 g/mol
Quality 661
SMILES C(C1=CC=CC=C1)CSC(F)(F)F
SPLASH splash10-052f-9130000000-4a9691c508ab18e6f273
Source of Spectrum QE-21-SM44-3e (DOI: 10.1002/chem.201503915)
Wiley ID 1907382