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1,3-Dimethylisoguaninium
SpectraBase Compound ID A1p1LgiDutn
InChI InChI=1S/C7H9N5O/c1-11-5(8)4-6(10-3-9-4)12(2)7(11)13/h3H,8H2,1-2H3/p+1
InChIKey GACQXROAVNQMHN-UHFFFAOYSA-O
Mol Weight 180.19 g/mol
Molecular Formula C7H10N5O
Exact Mass 180.088535 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IA67uIoqSKZ
Name 1,3-Dimethylisoguaninium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H10N5O
InChI InChI=1S/C7H9N5O/c1-11-5(8)4-6(10-3-9-4)12(2)7(11)13/h3H,8H2,1-2H3/p+1
InChIKey GACQXROAVNQMHN-UHFFFAOYSA-O
Molecular Weight 180.191 g/mol
SMILES NC=1N(C(N(C=2C1[NH+]=CN2)C)=O)C
SPLASH splash10-0fb9-2900000000-55079de84fbbad08c735
Source of Spectrum E2-51-733-1
Synonyms 6-Amino-1,3-dimethyl-2-oxo-2,3-dihydro-1H-purin-7-ium
Wiley ID 1556168