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3-(1-Hydroxyiminoethyl)-2-methylsulfanyl-7-trifluoromethyl-1H-quinolin-4-one

View entire compound with spectra: 1 MS (GC)

3-(1-Hydroxyiminoethyl)-2-methylsulfanyl-7-trifluoromethyl-1H-quinolin-4-one
SpectraBase Compound ID ATs3WO6pmi3
InChI InChI=1S/C13H11F3N2O2S/c1-6(18-20)10-11(19)8-4-3-7(13(14,15)16)5-9(8)17-12(10)21-2/h3-5,20H,1-2H3,(H,17,19)/b18-6+
InChIKey RRTWZKPQQCKSFO-NGYBGAFCSA-N
Mol Weight 316.3 g/mol
Molecular Formula C13H11F3N2O2S
Exact Mass 316.049333 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KGAU0WePQaw
Name 3-(1-Hydroxyiminoethyl)-2-methylsulfanyl-7-trifluoromethyl-1H-quinolin-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11F3N2O2S
InChI InChI=1S/C13H11F3N2O2S/c1-6(18-20)10-11(19)8-4-3-7(13(14,15)16)5-9(8)17-12(10)21-2/h3-5,20H,1-2H3,(H,17,19)/b18-6+
InChIKey RRTWZKPQQCKSFO-NGYBGAFCSA-N
Molecular Weight 316.298 g/mol
SMILES N1c2cc(ccc2C(C(\C(=N\O)C)=C1SC)=O)C(F)(F)F
SPLASH splash10-001i-0094000000-8dd1a2c73993d90d339f
Source of Spectrum F4-0-1603-1
Synonyms 3-[(1E)-N-hydroxyethanimidoyl]-2-(methylsulfanyl)-7-(trifluoromethyl)-4(1H)-quinolinone
Wiley ID 1619785