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N,N'-Bis(1H-pyrrolo[2,3-b]pyridine-6-yl)1,3-benzenedicarboxamide

View entire compound with spectra: 1 MS (GC)

N,N'-Bis(1H-pyrrolo[2,3-b]pyridine-6-yl)1,3-benzenedicarboxamide
SpectraBase Compound ID 3O81rXxnZlJ
InChI InChI=1S/C22H16N6O2/c29-21(27-17-6-4-13-8-10-23-19(13)25-17)15-2-1-3-16(12-15)22(30)28-18-7-5-14-9-11-24-20(14)26-18/h1-12H,(H2,23,25,27,29)(H2,24,26,28,30)
InChIKey ZZCUOGLBJLOSHX-UHFFFAOYSA-N
Mol Weight 396.41 g/mol
Molecular Formula C22H16N6O2
Exact Mass 396.133474 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gi7wtvAejUB
Name N,N'-Bis(1H-pyrrolo[2,3-b]pyridine-6-yl)1,3-benzenedicarboxamide
Alternate Name(s) N(1),N(3)-di(1H-pyrrolo[2,3-b]pyridin-6-yl)isophthalamide
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H16N6O2
InChI InChI=1S/C22H16N6O2/c29-21(27-17-6-4-13-8-10-23-19(13)25-17)15-2-1-3-16(12-15)22(30)28-18-7-5-14-9-11-24-20(14)26-18/h1-12H,(H2,23,25,27,29)(H2,24,26,28,30)
InChIKey ZZCUOGLBJLOSHX-UHFFFAOYSA-N
Molecular Weight 396.410 g/mol
SMILES [nH]1ccc2c1nc(NC(c1cc(C(Nc3nc4c(cc3)cc[nH]4)=O)ccc1)=O)cc2
SPLASH splash10-03di-0093000000-48def6345c760d62283e
Source of Spectrum AJ-65-2995-5
Wiley ID 771756