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9-METHYL-8-OXOISOGUANINE
SpectraBase Compound ID EyTxFylZKb6
InChI InChI=1S/C6H7N5O2/c1-11-4-2(8-6(11)13)3(7)9-5(12)10-4/h1H3,(H,8,13)(H3,7,9,10,12)
InChIKey SBQJKUPJMKHYDJ-UHFFFAOYSA-N
Mol Weight 181.15 g/mol
Molecular Formula C6H7N5O2
Exact Mass 181.059974 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FnNYqEPrcjk
Name 9-METHYL-8-OXOISOGUANINE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H7N5O2
InChI InChI=1S/C6H7N5O2/c1-11-4-2(8-6(11)13)3(7)9-5(12)10-4/h1H3,(H,8,13)(H3,7,9,10,12)
InChIKey SBQJKUPJMKHYDJ-UHFFFAOYSA-N
Literature Reference Author T.SAKURADA,M.B.GILL,S.FRAUSTO,B.COPITS,K.NOGUCHI,K.SHIMAMOTO ,G.T.SWANSON,R.SAKAI
Literature Reference Citation J.MED.CHEM.,53,6089(2010)
Literature Reference DOI 10.1021/jm100490m
Molecular Weight 181.154 g/mol
Solvent D2O+0.2N_HCl
Source File Reference UWMZ47459