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1-cyclopropyl-6,7-difluoro-4-keto-8-(trifluoromethyl)quinoline-3-carboxylic acid ethyl ester
SpectraBase Compound ID 7IPmoaxd1xl
InChI InChI=1S/C16H12F5NO3/c1-2-25-15(24)9-6-22(7-3-4-7)13-8(14(9)23)5-10(17)12(18)11(13)16(19,20)21/h5-7H,2-4H2,1H3
InChIKey OUKMZWIMFISXRO-UHFFFAOYSA-N
Mol Weight 361.27 g/mol
Molecular Formula C16H12F5NO3
Exact Mass 361.073734 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IwM5dgmrPZE
Name 1-cyclopropyl-6,7-difluoro-4-keto-8-(trifluoromethyl)quinoline-3-carboxylic acid ethyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C16H12F5NO3
InChI InChI=1S/C16H12F5NO3/c1-2-25-15(24)9-6-22(7-3-4-7)13-8(14(9)23)5-10(17)12(18)11(13)16(19,20)21/h5-7H,2-4H2,1H3
InChIKey OUKMZWIMFISXRO-UHFFFAOYSA-N
Molecular Weight 361.268 g/mol
SMILES C=1N(c2c(c(c(cc2C(C1C(=O)OCC)=O)F)F)C(F)(F)F)C1CC1
SPLASH splash10-03di-0009000000-13917d2478d60cf1521f
Source of Spectrum F2-35-366-15
Synonyms 1-cyclopropyl-6,7-difluoro-4-oxo-8-(trifluoromethyl)-3-quinolinecarboxylic acid ethyl ester ethyl 1-cyclopropyl-6,7-bis(fluoranyl)-4-oxidanylidene-8-(trifluoromethyl)quinoline-3-carboxylate ethyl 1-cyclopropyl-6,7-difluoro-4-oxo-8-(trifluoromethyl)quinoline-3-carboxylate
Wiley ID 1574243