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ZDDPFJMAMMZTJG-UHFFFAOYSA-N

View entire compound with spectra: 1 NMR

ZDDPFJMAMMZTJG-UHFFFAOYSA-N
SpectraBase Compound ID LB2FVcaoauJ
InChI InChI=1S/2C13H12N6O4/c2*20-11(8-5-14-1-3-16-8)18-7-10(13(22)23)19-12(21)9-6-15-2-4-17-9/h2*1-6,10H,7H2,(H,18,20)(H,19,21)(H,22,23)
InChIKey ZDDPFJMAMMZTJG-UHFFFAOYSA-N
Mol Weight 632.55 g/mol
Molecular Formula C26H24N12O8
Exact Mass 632.184006 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KL1ZwugRniD
Name ZDDPFJMAMMZTJG-UHFFFAOYSA-N
Compound Number 1D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H24N12O8
InChI InChI=1S/2C13H12N6O4/c2*20-11(8-5-14-1-3-16-8)18-7-10(13(22)23)19-12(21)9-6-15-2-4-17-9/h2*1-6,10H,7H2,(H,18,20)(H,19,21)(H,22,23)
InChIKey ZDDPFJMAMMZTJG-UHFFFAOYSA-N
Literature Reference Author R.RAJAGOPALAN,R.R.KUNTZ,U.SHARMA,W.A.VOLKERT,R.S.PANDURANGI
Literature Reference Citation J.ORG.CHEM.,67,6748(2002)
Literature Reference DOI 10.1021/jo010782u
Molecular Weight 632.552 g/mol
Solvent CDCl3
Source File Reference UWSI22074