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Ethyl 4-nitro-5-(4-trifluoromethylphenyl)pyrrolidine-2-carboxylate
SpectraBase Compound ID Go6qx3VXHok
InChI InChI=1S/C14H15F3N2O4/c1-2-23-13(20)10-7-11(19(21)22)12(18-10)8-3-5-9(6-4-8)14(15,16)17/h3-6,10-12,18H,2,7H2,1H3/t10-,11-,12-/m0/s1
InChIKey GJXOXLCLFNOAGW-SRVKXCTJSA-N
Mol Weight 332.28 g/mol
Molecular Formula C14H15F3N2O4
Exact Mass 332.098391 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HRqqeFUbLN4
Name Ethyl 4-nitro-5-(4-trifluoromethylphenyl)pyrrolidine-2-carboxylate
Alternate Name(s) (2S,4S,5S)-Ethyl 4-nitro-5-(4-trifluoromethylphenyl)pyrrolidine-2-carboxylate Ethyl 4-nitro-5-[4-(trifluoromethyl)phenyl]-2-pyrrolidinecarboxylate (2S,4S,5S)-4-nitro-5-[4-(trifluoromethyl)phenyl]-2-pyrrolidinecarboxylic acid ethyl ester Ethyl (2S,4S,5S)-4-nitro-5-[4-(trifluoromethyl)phenyl]pyrrolidine-2-carboxylate
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Formula C14H15F3N2O4
InChI InChI=1S/C14H15F3N2O4/c1-2-23-13(20)10-7-11(19(21)22)12(18-10)8-3-5-9(6-4-8)14(15,16)17/h3-6,10-12,18H,2,7H2,1H3/t10-,11-,12-/m0/s1
InChIKey GJXOXLCLFNOAGW-SRVKXCTJSA-N
Molecular Weight 332.279 g/mol
SMILES N1[C@@](C[C@@]([C@@]1(c1ccc(C(F)(F)F)cc1)[H])(N(=O)=O)[H])(C(=O)OCC)[H]
SPLASH splash10-03di-0290000000-de60308ee1b36f6e2ed5
Source of Spectrum F-56-642-3
Wiley ID 855645