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ROTAMER-#1
SpectraBase Compound ID 2v0So8Dg1Cr
InChI InChI=1S/C9H10N4O/c1-12(7-14)6-13-9-5-3-2-4-8(9)10-11-13/h2-5,7H,6H2,1H3
InChIKey IOKZFCRJZNIUNN-UHFFFAOYSA-N
Mol Weight 190.21 g/mol
Molecular Formula C9H10N4O
Exact Mass 190.085461 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LcHD5yFwK8q
Name ROTAMER-#2
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H10N4O
InChI InChI=1S/C9H10N4O/c1-12(7-14)6-13-9-5-3-2-4-8(9)10-11-13/h2-5,7H,6H2,1H3
InChIKey IOKZFCRJZNIUNN-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 190.205 g/mol
Solvent DMSO-D6
Source File Reference UWCS22528