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

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N,N'-Bis[6-(2-ethylhexanoylamino)pyrid-2-yl]-5-iodoisophthalamide
SpectraBase Compound ID AumKjeC3BZF
InChI InChI=1S/C34H43IN6O4/c1-5-9-13-22(7-3)31(42)38-27-15-11-17-29(36-27)40-33(44)24-19-25(21-26(35)20-24)34(45)41-30-18-12-16-28(37-30)39-32(43)23(8-4)14-10-6-2/h11-12,15-23H,5-10,13-14H2,1-4H3,(H2,36,38,40,42,44)(H2,37,39,41,43,45)
InChIKey ABSOKUVMEZMBDY-UHFFFAOYSA-N
Mol Weight 726.7 g/mol
Molecular Formula C34H43IN6O4
Exact Mass 726.239049 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E4kKSVAtOmU
Name N,N'-Bis[6-(2-ethylhexanoylamino)pyrid-2-yl]-5-iodoisophthalamide
Alternate Name(s) N1,N3-bis[6-[(2-ethyl-1-oxohexyl)amino]-2-pyridinyl]-5-iodobenzene-1,3-dicarboxamide 1-N,3-N-bis[6-(2-ethylhexanoylamino)pyridin-2-yl]-5-iodobenzene-1,3-dicarboxamide N1,N3-bis[6-(2-ethylhexanoylamino)-2-pyridyl]-5-iodo-benzene-1,3-dicarboxamide N1,N3-bis[6-(2-ethylhexanoylamino)pyridin-2-yl]-5-iodanyl-benzene-1,3-dicarboxamide
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Formula C34H43IN6O4
InChI InChI=1S/C34H43IN6O4/c1-5-9-13-22(7-3)31(42)38-27-15-11-17-29(36-27)40-33(44)24-19-25(21-26(35)20-24)34(45)41-30-18-12-16-28(37-30)39-32(43)23(8-4)14-10-6-2/h11-12,15-23H,5-10,13-14H2,1-4H3,(H2,36,38,40,42,44)(H2,37,39,41,43,45)
InChIKey ABSOKUVMEZMBDY-UHFFFAOYSA-N
Molecular Weight 726.660 g/mol
SMILES N(C(c1cc(C(Nc2nc(NC(=O)C(CC)CCCC)ccc2)=O)cc(c1)I)=O)c1nc(NC(=O)C(CC)CCCC)ccc1
SPLASH splash10-00b9-0000009100-bfc26a5697b5bcc7f3a3
Source of Spectrum U1-2011-2072-2a
Wiley ID 1665448