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2-Pyrazinecarboxylic acid, 3-[[(4-fluorophenyl)amino]carbonyl]-, ethyl ester
SpectraBase Compound ID JAsiVTZEhNN
InChI InChI=1S/C14H12FN3O3/c1-2-21-14(20)12-11(16-7-8-17-12)13(19)18-10-5-3-9(15)4-6-10/h3-8H,2H2,1H3,(H,18,19)
InChIKey UKDONFQXSBBFNH-UHFFFAOYSA-N
Mol Weight 289.27 g/mol
Molecular Formula C14H12FN3O3
Exact Mass 289.086269 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F1BkCWD8TwC
Name 2-Pyrazinecarboxylic acid, 3-[[(4-fluorophenyl)amino]carbonyl]-, ethyl ester
Alternate Name(s) 3-[(4-fluoroanilino)-oxomethyl]-2-pyrazinecarboxylic acid ethyl ester 3-[(4-fluorophenyl)carbamoyl]pyrazinic acid ethyl ester Ethyl 3-[(4-fluoroanilino)carbonyl]-2-pyrazinecarboxylate Ethyl 3-[(4-fluorophenyl)carbamoyl]pyrazine-2-carboxylate
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Formula C14H12FN3O3
InChI InChI=1S/C14H12FN3O3/c1-2-21-14(20)12-11(16-7-8-17-12)13(19)18-10-5-3-9(15)4-6-10/h3-8H,2H2,1H3,(H,18,19)
InChIKey UKDONFQXSBBFNH-UHFFFAOYSA-N
Molecular Weight 289.266 g/mol
SMILES N(C(c1nccnc1C(OCC)=O)=O)c1ccc(cc1)F
SPLASH splash10-0ufr-9830000000-86d2854c384752250b19
Wiley ID 1448904