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2-(Ethoxycarbonyl)-1-(methoxycarbonyl)-3-(4-methoxyphenyl)-4-nitro-5-phenylpyrrolidine isomer
SpectraBase Compound ID Eo2n3tU2iTS
InChI InChI=1S/C22H24N2O7/c1-4-31-21(25)20-17(14-10-12-16(29-2)13-11-14)19(24(27)28)18(23(20)22(26)30-3)15-8-6-5-7-9-15/h5-13,17-20H,4H2,1-3H3/t17-,18-,19+,20-/m0/s1
InChIKey ANSGNHXWYDRIAK-HAGHYFMRSA-N
Mol Weight 428.44 g/mol
Molecular Formula C22H24N2O7
Exact Mass 428.158351 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5d23JWsj2u8
Name 2-(Ethoxycarbonyl)-1-(methoxycarbonyl)-3-(4-methoxyphenyl)-4-nitro-5-phenylpyrrolidine isomer
Alternate Name(s) Ethyl 3-(4-Methoxyphenyl)N-carbomethoxy-5-phenyl-4-nitropyrrolidin-2-carboxylate (2S,3R,4R,5S)-2-(Ethoxycarbonyl)-1-(methoxycarbonyl)-3-(4-methoxyphenyl)-4-nitro-5-phenylpyrrolidine isomer (2S,3R,4R,5S)-3-(4-Methoxy-phenyl)-4-nitro-5-phenyl-pyrrolidine-1,2-dicarboxylic acid 2-ethyl ester 1-methyl ester 2-(Ethoxycarbonyl)-1-(methoxycarbonyl)-3-(4-methoxyphenyl)-4-nitro-5-phenylpyrrolidine 2-Ethyl 1-methyl 3-(4-methoxyphenyl)-4-nitro-5-phenyl-1,2-pyrrolidinedicarboxylate Ethyl 3-(4-Methoxyphenyl)N-carbomethoxy-5-phenyl-4-nitropyrrolidin-2-carboxylate isomer Ethyl N(1)-(methoxycarbonyl)-2-phenyl-4-(p-methoxyphenyl)-3-nitro-2,3,4,5-tetrahydropyrrole-5-carboxylate
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Formula C22H24N2O7
InChI InChI=1S/C22H24N2O7/c1-4-31-21(25)20-17(14-10-12-16(29-2)13-11-14)19(24(27)28)18(23(20)22(26)30-3)15-8-6-5-7-9-15/h5-13,17-20H,4H2,1-3H3/t17-,18-,19+,20-/m0/s1
InChIKey ANSGNHXWYDRIAK-HAGHYFMRSA-N
Molecular Weight 428.441 g/mol
SMILES [C@]1(N([C@]([C@@]([C@@]1(c1ccc(OC)cc1)[H])(N(=O)=O)[H])(c1ccccc1)[H])C(=O)OC)(C(=O)OCC)[H]
SPLASH splash10-0a4i-2139000000-7206e914ff8c57a7768b
Source of Spectrum F-56-8551-6
Wiley ID 859162