1-Methyladenine

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Systematic / IUPAC Name: 1-Methyl-1,9-dihydro-6H-purin-6-imine

ID: Reference1178

Other Names: 1-Methyl-1H-purin-6-amine;
N1-Methyladenine;
Adenine, 1-methyl-;
1H-Purin-6-amine, 1-methyl-;
6H-Purin-6-imine, 1,9-dihydro-1-methyl-

Formula: C6H7N5

Class: Endogenous Metabolites

Spectral Data

1-Methyladenine mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap Elite; Q Exactive Orbitrap
No. of Spectral Trees 4
No. of Spectra 357
Tandem Spectra MS1, MS2
Ionization Methods ESI; APCI; NSI
Analyzers FT
Last Modification 12/5/2014 8:51:20 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C6H7N5/c1-11-3-10-6-4(5(11)7)8-2-9-6/h2-3,7H,1H3,(H,8,9)
InChI Key SATCOUWSAZBIJO-UHFFFAOYSA-N
Canonical SMILES
CAS 1670695
Splash
Other Names 1-Methyl-1H-purin-6-amine;
N1-Methyladenine;
Adenine, 1-methyl-;
1H-Purin-6-amine, 1-methyl-;
6H-Purin-6-imine, 1,9-dihydro-1-methyl-

In Other Databases

KEGG C02216
ChemIDPlus 005142223
ChEBI CHEBI:18083
HMDb HMDB11599
Wikipedia 1-Methyladenin (DE)
ChemSpider 71157
ChEMBL CHEMBL304483
PubChem 78821