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ROTAMER-#1
SpectraBase Compound ID Fu9jbiDpqr3
InChI InChI=1S/C15H14N4O/c1-18(11-20)15(12-7-3-2-4-8-12)19-14-10-6-5-9-13(14)16-17-19/h2-11,15H,1H3
InChIKey IJBYIPWQGKQZOU-UHFFFAOYSA-N
Mol Weight 266.3 g/mol
Molecular Formula C15H14N4O
Exact Mass 266.116761 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 51M29KkB7dH
Name ROTAMER-#2
Compound Number 14B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H14N4O
InChI InChI=1S/C15H14N4O/c1-18(11-20)15(12-7-3-2-4-8-12)19-14-10-6-5-9-13(14)16-17-19/h2-11,15H,1H3
InChIKey IJBYIPWQGKQZOU-UHFFFAOYSA-N
Literature Reference Author A.R.KATRITZKY,G.YAO,X.LAN,X.ZHAO
Literature Reference Citation J.ORG.CHEM.,58,2086(1993)
Literature Reference DOI 10.1021/jo00060a025
Molecular Weight 266.302 g/mol
Solvent CDCl3
Source File Reference UWCS22546