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2-(CARBOETHOXY)-3-(4'-TRIFLUOROMETHYL)-PHENYLQUINOXALINE-1,4-DIOXIDE
SpectraBase Compound ID K9QfxBacdU5
InChI InChI=1S/C18H13F3N2O4/c1-2-27-17(24)16-15(11-7-9-12(10-8-11)18(19,20)21)22(25)13-5-3-4-6-14(13)23(16)26/h3-10H,2H2,1H3
InChIKey ZWIMOYLIPRXHSH-UHFFFAOYSA-N
Mol Weight 378.31 g/mol
Molecular Formula C18H13F3N2O4
Exact Mass 378.082741 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D1NiLS9Hk2z
Name 1-Oxido-4-oxo-3-[4-(trifluoromethyl)phenyl]-2-quinoxalin-4-iumcarboxylic acid ethyl ester
Alternate Name(s) 4-keto-1-oxido-3-[4-(trifluoromethyl)phenyl]quinoxalin-4-ium-2-carboxylic acid ethyl ester Ethyl 1-oxidanidyl-4-oxidanylidene-3-[4-(trifluoromethyl)phenyl]quinoxalin-4-ium-2-carboxylate Ethyl 1-oxido-4-oxo-3-[4-(trifluoromethyl)phenyl]quinoxalin-4-ium-2-carboxylate
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Formula C18H13F3N2O4
InChI InChI=1S/C18H13F3N2O4/c1-2-27-17(24)16-15(11-7-9-12(10-8-11)18(19,20)21)22(25)13-5-3-4-6-14(13)23(16)26/h3-10H,2H2,1H3
InChIKey ZWIMOYLIPRXHSH-UHFFFAOYSA-N
Molecular Weight 378.307 g/mol
SMILES c1([n+](c2c([n+](c1-c1ccc(C(F)(F)F)cc1)[O-])cccc2)[O-])C(=O)OCC
SPLASH splash10-004i-0749000000-2d740debb59bc43f07b7
Source of Spectrum AJ-42-1385-9
Wiley ID 1568278