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ethyl-6-[(trifluoromethyl)thio]hexanoate
SpectraBase Compound ID C9NdE1qUNDz
InChI InChI=1S/C9H15F3O2S/c1-2-14-8(13)6-4-3-5-7-15-9(10,11)12/h2-7H2,1H3
InChIKey GONZDDAXRCCTLU-UHFFFAOYSA-N
Mol Weight 244.27 g/mol
Molecular Formula C9H15F3O2S
Exact Mass 244.074485 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6k8qLfjq1Mv
Name ethyl-6-[(trifluoromethyl)thio]hexanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H15F3O2S
GC Column HP-5 (30 m x 320 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 300oC
InChI InChI=1S/C9H15F3O2S/c1-2-14-8(13)6-4-3-5-7-15-9(10,11)12/h2-7H2,1H3
InChIKey GONZDDAXRCCTLU-UHFFFAOYSA-N
Instrument Name Varian Saturn 2100 T
Ionization Type EI
Literature Reference DOI 10.1002/chem.201503915
Molecular Weight 244.272 g/mol
Quality 524
SMILES C(C)OC(CCCCCSC(F)(F)F)=O
SPLASH splash10-014p-7900000000-ade555a8b4796abb33d0
Source of Spectrum QE-21-SM44-3f (DOI: 10.1002/chem.201503915)
Wiley ID 1907383