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1-[(trifluoromethyl)thio]butane
SpectraBase Compound ID 85jVdkouWDN
InChI InChI=1S/C5H9F3S/c1-2-3-4-9-5(6,7)8/h2-4H2,1H3
InChIKey YAZOZCBGLHEBSI-UHFFFAOYSA-N
Mol Weight 158.18 g/mol
Molecular Formula C5H9F3S
Exact Mass 158.037706 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CDLsX8RzwJj
Name 1-[(trifluoromethyl)thio]butane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 158.037705953 u
Formula C5H9F3S
GC Column HP-5 (30 m x 320 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 300oC
InChI InChI=1S/C5H9F3S/c1-2-3-4-9-5(6,7)8/h2-4H2,1H3
InChIKey YAZOZCBGLHEBSI-UHFFFAOYSA-N
Instrument Name Varian Saturn 2100 T
Ionization Type EI
Literature Reference DOI 10.1002/chem.201503915
Molecular Weight 158.182 g/mol
Quality 391
SMILES C(SC(F)(F)F)CCC
SPLASH splash10-006x-9000000000-e472e95bbf53974e5397
Source of Spectrum QE-21-SM40-3a (DOI: 10.1002/chem.201503915)
Wiley ID 1907378