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N,N'-Bis[6-(2-ethylhexanoylamino)pyrid-2-yl]-5-nitroisophthalamide

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N,N'-Bis[6-(2-ethylhexanoylamino)pyrid-2-yl]-5-nitroisophthalamide
SpectraBase Compound ID 3u71XiIaJzk
InChI InChI=1S/C34H43N7O6/c1-5-9-13-22(7-3)31(42)37-27-15-11-17-29(35-27)39-33(44)24-19-25(21-26(20-24)41(46)47)34(45)40-30-18-12-16-28(36-30)38-32(43)23(8-4)14-10-6-2/h11-12,15-23H,5-10,13-14H2,1-4H3,(H2,35,37,39,42,44)(H2,36,38,40,43,45)
InChIKey BQEPKPQDQYDOFP-UHFFFAOYSA-N
Mol Weight 645.8 g/mol
Molecular Formula C34H43N7O6
Exact Mass 645.327482 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2qZcyQbE7RR
Name N,N'-Bis[6-(2-ethylhexanoylamino)pyrid-2-yl]-5-nitroisophthalamide
Alternate Name(s) N1,N3-bis[6-[(2-ethyl-1-oxohexyl)amino]-2-pyridinyl]-5-nitrobenzene-1,3-dicarboxamide 1-N,3-N-bis[6-(2-ethylhexanoylamino)pyridin-2-yl]-5-nitrobenzene-1,3-dicarboxamide N1,N3-bis[6-(2-ethylhexanoylamino)-2-pyridyl]-5-nitro-benzene-1,3-dicarboxamide N1,N3-bis[6-(2-ethylhexanoylamino)pyridin-2-yl]-5-nitro-benzene-1,3-dicarboxamide
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Formula C34H43N7O6
InChI InChI=1S/C34H43N7O6/c1-5-9-13-22(7-3)31(42)37-27-15-11-17-29(35-27)39-33(44)24-19-25(21-26(20-24)41(46)47)34(45)40-30-18-12-16-28(36-30)38-32(43)23(8-4)14-10-6-2/h11-12,15-23H,5-10,13-14H2,1-4H3,(H2,35,37,39,42,44)(H2,36,38,40,43,45)
InChIKey BQEPKPQDQYDOFP-UHFFFAOYSA-N
Molecular Weight 645.761 g/mol
SMILES N(C(c1cc(cc(C(Nc2nc(NC(=O)C(CC)CCCC)ccc2)=O)c1)N(=O)=O)=O)c1nc(NC(=O)C(CC)CCCC)ccc1
SPLASH splash10-0002-0000091000-7b994507f42dea3a7d76
Source of Spectrum U1-2011-2072-2b
Wiley ID 1665447