CID 122206299

352457-34-2

Structural Information

Molecular Formula
C9H13N5O2
SMILES
CC1=NC(=C(C(=O)N1)NC2=NCCN2)OC
InChI
InChI=1S/C9H13N5O2/c1-5-12-7(15)6(8(13-5)16-2)14-9-10-3-4-11-9/h3-4H2,1-2H3,(H2,10,11,14)(H,12,13,15)
InChIKey
MFFANMLJBOSKIX-UHFFFAOYSA-N
Compound name
5-(4,5-dihydro-1H-imidazol-2-ylamino)-4-methoxy-2-methyl-1H-pyrimidin-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

223.10692 Da
Monoisotopic Mass

-1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.11420 149.3
[M+Na]+ 246.09614 158.3
[M-H]- 222.09964 149.0
[M+NH4]+ 241.14074 162.5
[M+K]+ 262.07008 153.9
[M+H-H2O]+ 206.10418 140.3
[M+HCOO]- 268.10512 168.0
[M+CH3COO]- 282.12077 184.7
[M+Na-2H]- 244.08159 153.6
[M]+ 223.10637 146.9
[M]- 223.10747 146.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.