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3,7-DIMETHYLISOGUANINE
SpectraBase Compound ID 4DMpfSfvLXc
InChI InChI=1S/C7H9N5O/c1-11-3-9-6-4(11)5(8)10-7(13)12(6)2/h3H,1-2H3,(H2,8,10,13)
InChIKey JZQHSYUUSIOKEV-UHFFFAOYSA-N
Mol Weight 179.18 g/mol
Molecular Formula C7H9N5O
Exact Mass 179.08071 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LXMNud8tqvb
Name 3,7-DIMETHYLISOGUANINE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H9N5O
InChI InChI=1S/C7H9N5O/c1-11-3-9-6-4(11)5(8)10-7(13)12(6)2/h3H,1-2H3,(H2,8,10,13)
InChIKey JZQHSYUUSIOKEV-UHFFFAOYSA-N
Literature Reference Author X.FU,P.L.NG,F.J.SCHMITZ,M.B.HOSSAIN,D.VANDERHELM,M.KELLY-BOR GES
Literature Reference Citation J.NAT.PROD.,59,1104(1996)
Literature Reference DOI 10.1021/np9604947
Molecular Weight 179.181 g/mol
Solvent DMSO-D6:TFA-D
Source File Reference UWVP685