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Dimethyl 2-methyl-c-5-[1'-(1"-ethoxycarbonyl-2"-oxocyclohexyl)ethyl]pyrrolidine-s-2,c-4-dicarboxylate
SpectraBase Compound ID JXKdorVgt4d
InChI InChI=1S/C20H31NO7/c1-5-28-18(25)20(10-7-6-8-15(20)22)11-9-14-13(16(23)26-3)12-19(2,21-14)17(24)27-4/h13-14,21H,5-12H2,1-4H3/t13-,14-,19-,20?/m0/s1
InChIKey UGRVFGXMHCXFJG-NRFVGKODSA-N
Mol Weight 397.47 g/mol
Molecular Formula C20H31NO7
Exact Mass 397.210052 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JBiWV9PeR9h
Name Dimethyl 2-methyl-c-5-[1'-(1"-ethoxycarbonyl-2"-oxocyclohexyl)ethyl]pyrrolidine-s-2,c-4-dicarboxylate
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Formula C20H31NO7
InChI InChI=1S/C20H31NO7/c1-5-28-18(25)20(10-7-6-8-15(20)22)11-9-14-13(16(23)26-3)12-19(2,21-14)17(24)27-4/h13-14,21H,5-12H2,1-4H3/t13-,14-,19-,20?/m0/s1
InChIKey UGRVFGXMHCXFJG-NRFVGKODSA-N
Molecular Weight 397.468 g/mol
SMILES N1[C@]([C@](C[C@]1(C(=O)OC)C)(C(=O)OC)[H])(CCC1(C(=O)OCC)C(=O)CCCC1)[H]
SPLASH splash10-000i-0029000000-ad9c324543f8ebcc5752
Source of Spectrum F-55-1772-3
Synonyms (2S,4S,5S)-Dimethyl 2-methyl-5-[2'-(1''-ethoxycarbonyl-2''-oxocyclohexyl)ethyl]pyrrolidine-2,4-dicarboxylate Dimethyl (2S,4S,5S)-5-{(1R)-1-[1-(ethoxycarbonyl)-2-oxocyclohexyl]ethyl}-2-methyl-2,4-pyrrolidinedicarboxylate Dimethyl 2-methyl-c-5-[1'-(1''-ethoxycarbonyl-2''-oxocyclohexyl)ethyl]pyrrolidine-r-2,c-4-dicarboxylate
Wiley ID 836723