Thymine

enlarge

Systematic / IUPAC Name: 5-Methyl-2,4-pyrimidinediol

ID: Reference677

Other Names: 5-Methyluracil;
2,4-Dihydroxy-5-methylpyrimidine;
5-Methylpyrimidine-2,4-dione;
5-Methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione;
5-Methyl-1,3-dihydropyrimidine-2,4-dione ; more

Formula: C5H6N2O2

Class: Endogenous Metabolites

Spectral Data

Thymine 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
No. of Spectral Trees 1
No. of Spectra 71
Tandem Spectra MS1, MS2, MS3
Ionization Methods ESI
Analyzers FT
Last Modification 2/19/2015 1:01:37 PM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C5H6N2O2/c1-3-2-6-5(9)7-4(3)8/h2H,1H3,(H2,6,7,8,9)
InChI Key RWQNBRDOKXIBIV-UHFFFAOYSA-N
Canonical SMILES CC1=CNC(=O)NC1=O
CAS 65714
Splash
Other Names 5-Methyluracil;
2,4-Dihydroxy-5-methylpyrimidine;
5-Methylpyrimidine-2,4-dione;
5-Methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione;
5-Methyl-1,3-dihydropyrimidine-2,4-dione;
4-Hydroxy-5-methylpyrimidin-2(1H)-one;
Thymin

In Other Databases

PubChem 1135
ChEMBL CHEMBL993
KEGG C00178
Wikipedia Thymine
ChemIDPlus 000065714; 002792474; 028806146; 118573583
ChEBI CHEBI:17821
ChemSpider 1103; 21239027
HMDb HMDB00262