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3-(Trifluoromethylthio)-2-butanone
SpectraBase Compound ID 3FEaZ6LW65C
InChI InChI=1S/C5H7F3OS/c1-3(9)4(2)10-5(6,7)8/h4H,1-2H3
InChIKey LLBNJDJZHRWHGN-UHFFFAOYSA-N
Mol Weight 172.17 g/mol
Molecular Formula C5H7F3OS
Exact Mass 172.016971 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EVAXACkPqsx
Name 3-(Trifluoromethylthio)-2-butanone
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H7F3OS
InChI InChI=1S/C5H7F3OS/c1-3(9)4(2)10-5(6,7)8/h4H,1-2H3
InChIKey LLBNJDJZHRWHGN-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cber.19731060507
Molecular Weight 172.165 g/mol
SMILES C(SC(F)(F)F)(C(C)=O)C
SPLASH splash10-0006-9300000000-036a1346e4c33dba3efd
Source of Spectrum K-106-1420-2b
Synonyms 3-((trifluoromethyl)thio)butan-2-one
Wiley ID 1793526