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XYZOALYNLZIMLJ-UWVGGRQHSA-N
SpectraBase Compound ID 4mjTbLqmw55
InChI InChI=1S/C12H12N4O/c1-2-11(17)9-6-12(7-13,8-14)16-10(9)4-3-5-15-16/h3-5,9-10H,2,6H2,1H3/t9-,10-/m0/s1
InChIKey XYZOALYNLZIMLJ-UWVGGRQHSA-N
Mol Weight 228.25 g/mol
Molecular Formula C12H12N4O
Exact Mass 228.101111 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AsK7cldBzWi
Name XYZOALYNLZIMLJ-UWVGGRQHSA-N
Compound Number 3
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H12N4O
InChI InChI=1S/C12H12N4O/c1-2-11(17)9-6-12(7-13,8-14)16-10(9)4-3-5-15-16/h3-5,9-10H,2,6H2,1H3/t9-,10-/m0/s1
InChIKey XYZOALYNLZIMLJ-UWVGGRQHSA-N
Literature Reference Author R.N.BUTLER,W.J.CUNNINGHAM,A.G.COYNE,L.A.BURKE
Literature Reference Citation J.AM.CHEM.SOC.,126,11923(2004)
Literature Reference DOI 10.1021/ja040119y
Molecular Weight 228.253 g/mol
Solvent CDCl3
Source File Reference UWLU35105