CID 81152

6-amino-1,3-dimethyluracil

Structural Information

Molecular Formula

C₆H₉N₃O₂

SMILES

CN1C(=CC(=O)N(C1=O)C)N

InChI

InChI=1S/C6H9N3O2/c1-8-4(7)3-5(10)9(2)6(8)11/h3H,7H2,1-2H3

InChIKey

VFGRNTYELNYSKJ-UHFFFAOYSA-N

Compound name

6-amino-1,3-dimethylpyrimidine-2,4-dione

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 11
References: 736
Patents: 155.06947 Da
Monoisotopic Mass: -1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	156.07675	129.0
[M+Na]+	178.05869	142.2
[M+NH4]+	173.10329	135.7
[M+K]+	194.03263	137.6
[M-H]-	154.06219	129.5
[M+Na-2H]-	176.04414	134.7
[M]+	155.06892	130.8
[M]-	155.07002	130.8

Literature stripe

literature stripe

Patent stripe

patents stripe