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3-(4-nitrophenyl)-2-(trifluoromethyl)-1-indolizinecarboxylic acid ethyl ester
SpectraBase Compound ID lKmyAJJLYT
InChI InChI=1S/C18H13F3N2O4/c1-2-27-17(24)14-13-5-3-4-10-22(13)16(15(14)18(19,20)21)11-6-8-12(9-7-11)23(25)26/h3-10H,2H2,1H3
InChIKey AWDBHKBFBJTBCB-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 JcbK7DyT650
Name 3-(4-nitrophenyl)-2-(trifluoromethyl)-1-indolizinecarboxylic acid ethyl ester
Alternate Name(s) 3-(4-nitrophenyl)-2-(trifluoromethyl)indolizine-1-carboxylic acid ethyl ester Ethyl 3-(4-nitrophenyl)-2-(trifluoromethyl)indolizine-1-carboxylate
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Formula C18H13F3N2O4
InChI InChI=1S/C18H13F3N2O4/c1-2-27-17(24)14-13-5-3-4-10-22(13)16(15(14)18(19,20)21)11-6-8-12(9-7-11)23(25)26/h3-10H,2H2,1H3
InChIKey AWDBHKBFBJTBCB-UHFFFAOYSA-N
Molecular Weight 378.307 g/mol
SMILES c1(c(c([n]2C=CC=Cc12)-c1ccc(cc1)N(=O)=O)C(F)(F)F)C(=O)OCC
SPLASH splash10-004i-0019000000-600d02ce9abd031dffde
Source of Spectrum K-2001-3209-6
Wiley ID 1580170