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4,6-Dibromo-N,N'-bis[6-(pentanoylamino)pyrid-2-yl]isophthalamide
SpectraBase Compound ID 3kzR8s0XyZ0
InChI InChI=1S/C28H30Br2N6O4/c1-3-5-13-25(37)33-21-9-7-11-23(31-21)35-27(39)17-15-18(20(30)16-19(17)29)28(40)36-24-12-8-10-22(32-24)34-26(38)14-6-4-2/h7-12,15-16H,3-6,13-14H2,1-2H3,(H2,31,33,35,37,39)(H2,32,34,36,38,40)
InChIKey HNWZVIQNFDIRAT-UHFFFAOYSA-N
Mol Weight 674.39 g/mol
Molecular Formula C28H30Br2N6O4
Exact Mass 672.069529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KWOfwii6SJR
Name 4,6-Dibromo-N,N'-bis[6-(pentanoylamino)pyrid-2-yl]isophthalamide
Comments Less than 3 mono-isotopic peaks
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Formula C28H30Br2N6O4
InChI InChI=1S/C28H30Br2N6O4/c1-3-5-13-25(37)33-21-9-7-11-23(31-21)35-27(39)17-15-18(20(30)16-19(17)29)28(40)36-24-12-8-10-22(32-24)34-26(38)14-6-4-2/h7-12,15-16H,3-6,13-14H2,1-2H3,(H2,31,33,35,37,39)(H2,32,34,36,38,40)
InChIKey HNWZVIQNFDIRAT-UHFFFAOYSA-N
Molecular Weight 674.394 g/mol
SMILES N(C(c1cc(C(Nc2nc(ccc2)NC(=O)CCCC)=O)c(cc1Br)Br)=O)c1nc(ccc1)NC(=O)CCCC
SPLASH splash10-00fr-0000009000-a8a9cb75031580e1f279
Source of Spectrum U1-2011-2072-1c
Synonyms 4,6-dibromo-N1,N3-bis[6-(1-oxopentylamino)-2-pyridinyl]benzene-1,3-dicarboxamide 4,6-dibromo-1-N,3-N-bis[6-(pentanoylamino)pyridin-2-yl]benzene-1,3-dicarboxamide 4,6-dibromo-N1,N3-bis[6-(pentanoylamino)-2-pyridyl]benzene-1,3-dicarboxamide 4,6-bis(bromanyl)-N1,N3-bis[6-(pentanoylamino)pyridin-2-yl]benzene-1,3-dicarboxamide
Wiley ID 1665449