Adenine
296
Reference
Adenine Structure
Systematic / IUPAC Name: 7H-Purin-6-amine
ID: Reference296
Other Names:
6-Aminopurine;
6-Amino-1H-purine;
Purine, 6-amino-;
1,6-Dihydro-6-iminopurine;
1H-Purine, 6-amino-
; more
Formula: C5H5N5
Class: Endogenous Metabolites
Spectral Data
Adenine mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Orbitrap Elite |
| No. of Spectral Trees | 3 |
| No. of Spectra | 358 |
| Tandem Spectra | MS1, MS2 |
| Ionization Methods | ESI |
| Analyzers | FT |
| Last Modification | 12/10/2014 9:25:31 AM |
Identificators
| InChI | InChI=1S/C5H5N5/c6-4-3-5(9-1-7-3)10-2-8-4/h1-2H,(H3,6,7,8,9,10) |
| InChI Key | GFFGJBXGBJISGV-UHFFFAOYSA-N |
| Canonical SMILES | C1=NC2=NC=NC2=C(N1)N |
| CAS | 73245 |
| Splash | |
| Other Names |
6-Aminopurine; 6-Amino-1H-purine; Purine, 6-amino-; 1,6-Dihydro-6-iminopurine; 1H-Purine, 6-amino-; 1,6-Dihydro-6-imnopurine; 1H-Purine-6-amine; 6H-Purin-6-imine, 1,9-dihydro-; Adenin; Vitamin B4; Leuco-4; Pedatisectine B; ADE |