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(4R,5R)-1-[(2-Methylamino-6-nitrophenyl)]cyclohexene-4,5-dicarboxylic acid dimethyl ester
SpectraBase Compound ID IJY9Oo3pNep
InChI InChI=1S/C17H20N2O6/c1-18-13-5-4-6-14(19(22)23)15(13)10-7-8-11(16(20)24-2)12(9-10)17(21)25-3/h4-7,11-12,18H,8-9H2,1-3H3/t11-,12-/m1/s1
InChIKey BIDBKTKLJFEIHE-VXGBXAGGSA-N
Mol Weight 348.36 g/mol
Molecular Formula C17H20N2O6
Exact Mass 348.132136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2deTmTnhsca
Name (4R,5R)-1-[(2-Methylamino-6-nitrophenyl)]cyclohexene-4,5-dicarboxylic acid dimethyl ester
Alternate Name(s) (4R,5R)-1-[2-(2-Methylamino-6-nitrophenyl)]cyclohexene-4,5-dicarboxylic acid dimethyl ester Dimethyl (1R,2R)-4-[2-(methylamino)-6-nitrophenyl]-4-cyclohexene-1,2-dicarboxylate trans-1-[2-(1-Methylamino-6-nitrophenyl)]cyclohexene-4,5-dicarboxylic acid dimethyl ester trans-1-[2-(2-Methylamino-6-nitrophenyl)]cyclohexene-4,5-dicarboxylic acid dimethyl ester
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Formula C17H20N2O6
InChI InChI=1S/C17H20N2O6/c1-18-13-5-4-6-14(19(22)23)15(13)10-7-8-11(16(20)24-2)12(9-10)17(21)25-3/h4-7,11-12,18H,8-9H2,1-3H3/t11-,12-/m1/s1
InChIKey BIDBKTKLJFEIHE-VXGBXAGGSA-N
Molecular Weight 348.355 g/mol
SMILES N(c1c(C=2C[C@@](C(=O)OC)([C@@](CC2)(C(=O)OC)[H])[H])c(N(=O)=O)ccc1)C
SPLASH splash10-001j-0297000000-babd2c8cea63575addb3
Source of Spectrum F-49-10025-16
Wiley ID 788577