CID 130153255

1-ethyl-2-methyl-1,4-dihydropyrimidin-4-one

Structural Information

Molecular Formula
C7H10N2O
SMILES
CCN1C=CC(=O)N=C1C
InChI
InChI=1S/C7H10N2O/c1-3-9-5-4-7(10)8-6(9)2/h4-5H,3H2,1-2H3
InChIKey
CJQMTKXEKKNLNY-UHFFFAOYSA-N
Compound name
1-ethyl-2-methylpyrimidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

138.07932 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.08660 125.2
[M+Na]+ 161.06854 135.8
[M-H]- 137.07204 126.9
[M+NH4]+ 156.11314 145.0
[M+K]+ 177.04248 134.1
[M+H-H2O]+ 121.07658 118.7
[M+HCOO]- 183.07752 148.3
[M+CH3COO]- 197.09317 174.1
[M+Na-2H]- 159.05399 133.3
[M]+ 138.07877 127.0
[M]- 138.07987 127.0
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.