Isocytosine

enlarge

Systematic / IUPAC Name: 2-Amino-4(1H)-pyrimidinone

ID: Reference3278

Other Names: BR-23592;
2-Amino-1H-pyrimidin-6-one;
2-Amino-3,4-dihydropyrimidin-4-one;
2-Amino-3H-pyrimidin-4-one;
2-Amino-3-hydropyrimidin-4-one ; more

Formula: C4H5N3O

Spectral Data

Isocytosine 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 Q Exactive Orbitrap
No. of Spectral Trees 2
No. of Spectra 238
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 11/9/2015 8:39:26 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C4H5N3O/c5-4-6-2-1-3(8)7-4/h1-2H,(H3,5,6,7,8)
InChI Key XQCZBXHVTFVIFE-UHFFFAOYSA-N
Canonical SMILES C1=CN=C(NC1=O)N
CAS 108532
Splash
Other Names BR-23592;
2-Amino-1H-pyrimidin-6-one;
2-Amino-3,4-dihydropyrimidin-4-one;
2-Amino-3H-pyrimidin-4-one;
2-Amino-3-hydropyrimidin-4-one;
2-Amino-4-hydroxypyrimidine;
2-Amino-4-oxypyrimidine;
2-Amino-4-pyrimdinol;
2-Amino-4-pyrimidol;
2-Amino-4-pyrimidone;
2-Aminopyrimidin-4(1H)-one;
2-Aminopyrimidin-4-ol;
2-Aminouracil;
4(1H)-Pyrimidinone,2,3-dihydro-2-imino-;
4(3H)-Pyrimidinone, 2-amino-;
4-Pyrimidinol, 2-amino-

In Other Databases

PubChem 66950
ChemIDPlus 000108532
ChemSpider 60309
ChEBI CHEBI:55502
Wikipedia Isocytosine