CID 3087488

Pyrimidine, 4-(1h-imidazol-1-yl)-6-methoxy-

Structural Information

Molecular Formula
C8H8N4O
SMILES
COC1=NC=NC(=C1)N2C=CN=C2
InChI
InChI=1S/C8H8N4O/c1-13-8-4-7(10-5-11-8)12-3-2-9-6-12/h2-6H,1H3
InChIKey
JZJJPJWXORKLGK-UHFFFAOYSA-N
Compound name
4-imidazol-1-yl-6-methoxypyrimidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

176.06981 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.07709 135.6
[M+Na]+ 199.05903 149.6
[M+NH4]+ 194.10363 142.9
[M+K]+ 215.03297 145.4
[M-H]- 175.06253 136.9
[M+Na-2H]- 197.04448 144.4
[M]+ 176.06926 137.8
[M]- 176.07036 137.8
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

patents stripe