CID 135437273

2-methoxy-6-methyl-3,4-dihydropyrimidin-4-one

Structural Information

Molecular Formula
C6H8N2O2
SMILES
CC1=CC(=O)NC(=N1)OC
InChI
InChI=1S/C6H8N2O2/c1-4-3-5(9)8-6(7-4)10-2/h3H,1-2H3,(H,7,8,9)
InChIKey
CRYUGFDHGVCIJW-UHFFFAOYSA-N
Compound name
2-methoxy-4-methyl-1H-pyrimidin-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

34
Patents

140.05858 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.065856 124.8
[M+Na]+ 163.047798 135.3
[M-H]- 139.051304 125.3
[M+NH4]+ 158.092403 143.7
[M+K]+ 179.021738 133.4
[M+H-H2O]+ 123.055840 118.5
[M+HCOO]- 185.056781 146.9
[M+CH3COO]- 199.072431 170.5
[M+Na-2H]- 161.033246 132.8
[M]+ 140.05803142 125.8
[M]- 140.05912858 125.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe