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Dimethyl 2-(4-nitrophenyl)-2-[2-(4-nitrophenyl)ethyl]pentanedioate
SpectraBase Compound ID HzEAenmc9KD
InChI InChI=1S/C21H22N2O8/c1-30-19(24)12-14-21(20(25)31-2,16-5-9-18(10-6-16)23(28)29)13-11-15-3-7-17(8-4-15)22(26)27/h3-10H,11-14H2,1-2H3
InChIKey CGSCBPVKINFYGB-UHFFFAOYSA-N
Mol Weight 430.41 g/mol
Molecular Formula C21H22N2O8
Exact Mass 430.137616 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 87eXY90e9BJ
Name Dimethyl 2-(4-nitrophenyl)-2-[2-(4-nitrophenyl)ethyl]pentanedioate
Alternate Name(s) 2-(4-nitrophenyl)-2-[2-(4-nitrophenyl)ethyl]pentanedioic acid dimethyl ester
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Formula C21H22N2O8
InChI InChI=1S/C21H22N2O8/c1-30-19(24)12-14-21(20(25)31-2,16-5-9-18(10-6-16)23(28)29)13-11-15-3-7-17(8-4-15)22(26)27/h3-10H,11-14H2,1-2H3
InChIKey CGSCBPVKINFYGB-UHFFFAOYSA-N
Molecular Weight 430.413 g/mol
SMILES c1(N(=O)=O)ccc(CCC(C(=O)OC)(CCC(=O)OC)c2ccc(N(=O)=O)cc2)cc1
SPLASH splash10-001j-0292000000-836a176996df12304810
Source of Spectrum SK-26-2005-4
Wiley ID 867213