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Ethyl 4-nitro-5-(4-methylphenyl)pyrrolidine-2-carboxylate
SpectraBase Compound ID BzerN8mPRio
InChI InChI=1S/C14H18N2O4/c1-3-20-14(17)11-8-12(16(18)19)13(15-11)10-6-4-9(2)5-7-10/h4-7,11-13,15H,3,8H2,1-2H3/t11-,12-,13-/m0/s1
InChIKey KKLIXSFBCMPQLD-AVGNSLFASA-N
Mol Weight 278.31 g/mol
Molecular Formula C14H18N2O4
Exact Mass 278.126657 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8qiCsVI01u1
Name Ethyl 4-nitro-5-(4-methylphenyl)pyrrolidine-2-carboxylate
Alternate Name(s) (2S,4S,5S)-Ethyl 4-nitro-5-(4-methylphenyl)pyrrolidine-2-carboxylate Ethyl 5-(4-methylphenyl)-4-nitro-2-pyrrolidinecarboxylate (2S,4S,5S)-5-(4-methylphenyl)-4-nitro-2-pyrrolidinecarboxylic acid ethyl ester Ethyl (2S,4S,5S)-5-(4-methylphenyl)-4-nitropyrrolidine-2-carboxylate Ethyl (2S,4S,5S)-4-nitro-5-(p-tolyl)pyrrolidine-2-carboxylate Ethyl (2S,4S,5S)-5-(4-methylphenyl)-4-nitro-pyrrolidine-2-carboxylate
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Formula C14H18N2O4
InChI InChI=1S/C14H18N2O4/c1-3-20-14(17)11-8-12(16(18)19)13(15-11)10-6-4-9(2)5-7-10/h4-7,11-13,15H,3,8H2,1-2H3/t11-,12-,13-/m0/s1
InChIKey KKLIXSFBCMPQLD-AVGNSLFASA-N
Molecular Weight 278.308 g/mol
SMILES N1[C@@](C[C@@]([C@@]1(c1ccc(cc1)C)[H])(N(=O)=O)[H])(C(=O)OCC)[H]
SPLASH splash10-0a4i-2930000000-5044153d653aa62570ea
Source of Spectrum F-56-642-3
Wiley ID 855646