CID 75520

6-amino-1-methyluracil

Structural Information

Molecular Formula

C₅H₇N₃O₂

SMILES

CN1C(=CC(=O)NC1=O)N

InChI

InChI=1S/C5H7N3O2/c1-8-3(6)2-4(9)7-5(8)10/h2H,6H2,1H3,(H,7,9,10)

InChIKey

GZLZRPNUDBIQBM-UHFFFAOYSA-N

Compound name

6-amino-1-methylpyrimidine-2,4-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 409
Patents: 141.05383 Da
Monoisotopic Mass: -1.3
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]+	142.06111	124.9
[M+Na]+	164.04305	137.3
[M+NH4]+	159.08765	131.3
[M+K]+	180.01699	133.1
[M-H]-	140.04655	124.9
[M+Na-2H]-	162.02850	130.4
[M]+	141.05328	126.3
[M]-	141.05438	126.3

Literature stripe

literature stripe

Patent stripe

patents stripe