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ATPNHWGPQLQMSF-OKILXGFUSA-N

View entire compound with spectra: 1 NMR

ATPNHWGPQLQMSF-OKILXGFUSA-N
SpectraBase Compound ID FsgEij62UPE
InChI InChI=1S/C14H10N6O2/c21-11-17-13-7-3-1-5-15-9(7)10-8(4-2-6-16-10)14(13,19-11)20-12(22)18-13/h1-6H,(H2,17,19,21)(H2,18,20,22)/t13-,14+
InChIKey ATPNHWGPQLQMSF-OKILXGFUSA-N
Mol Weight 294.27 g/mol
Molecular Formula C14H10N6O2
Exact Mass 294.086524 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GcFqMyBpVHr
Name ATPNHWGPQLQMSF-OKILXGFUSA-N
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H10N6O2
InChI InChI=1S/C14H10N6O2/c21-11-17-13-7-3-1-5-15-9(7)10-8(4-2-6-16-10)14(13,19-11)20-12(22)18-13/h1-6H,(H2,17,19,21)(H2,18,20,22)/t13-,14+
InChIKey ATPNHWGPQLQMSF-OKILXGFUSA-N
Literature Reference Author J.A.A.W.ELEMANS,A.E.ROWAN,R.J.M.NOLTE
Literature Reference Citation J.AM.CHEM.SOC.,124,1532(2002)
Literature Reference DOI 10.1021/ja012061i
Molecular Weight 294.272 g/mol
Sample ID 47627
Solvent DMSO-D6