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1,3-Dimethylisoguaninium
SpectraBase Compound ID 55FqKxd5NJC
InChI InChI=1S/C7H9N5O/c1-11-5(8)4-6(10-3-9-4)12(2)7(11)13/h3,8H,1-2H3,(H,9,10)/p+1
InChIKey SZMYTAKQGWDBJI-UHFFFAOYSA-O
Mol Weight 180.19 g/mol
Molecular Formula C7H10N5O
Exact Mass 180.088535 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4jxys7jCXqX
Name 1,3-DIMETHYLISOGUANINIUM
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H10N5O
InChI InChI=1S/C7H9N5O/c1-11-5(8)4-6(10-3-9-4)12(2)7(11)13/h3,8H,1-2H3,(H,9,10)/p+1
InChIKey SZMYTAKQGWDBJI-UHFFFAOYSA-O
Literature Reference Author S.J.JEONG,M.INAGAKI,R.HIGUCHI,T.MIYAMOTO,M.ONO,M.KUWANO,R.W. M.V.SOEST
Literature Reference Citation CHEM.PHARM.BULL.,51,731(2003)
Literature Reference DOI 10.1248/cpb.51.731
Molecular Weight 180.189 g/mol
Sample ID 31272
Solvent CD3OD