CID 1644232

56075-76-4

Structural Information

Molecular Formula

C₇H₁₁N₃O₃

SMILES

COCCN1C(=CC(=O)NC1=O)N

InChI

InChI=1S/C7H11N3O3/c1-13-3-2-10-5(8)4-6(11)9-7(10)12/h4H,2-3,8H2,1H3,(H,9,11,12)

InChIKey

YZEWEIJSLLACIN-UHFFFAOYSA-N

Compound name

6-amino-1-(2-methoxyethyl)pyrimidine-2,4-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 44
Patents: 185.08005 Da
Monoisotopic Mass: -1.4
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]+	186.08733	136.9
[M+Na]+	208.06927	148.4
[M+NH4]+	203.11387	142.4
[M+K]+	224.04321	144.3
[M-H]-	184.07277	136.3
[M+Na-2H]-	206.05472	141.4
[M]+	185.07950	138.0
[M]-	185.08060	138.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe