CID 19804694

121553-48-8

Structural Information

Molecular Formula
C8H10N2O
SMILES
CC1=CC(=NC(=O)N1)C2CC2
InChI
InChI=1S/C8H10N2O/c1-5-4-7(6-2-3-6)10-8(11)9-5/h4,6H,2-3H2,1H3,(H,9,10,11)
InChIKey
QODMYONMGSMOCI-UHFFFAOYSA-N
Compound name
4-cyclopropyl-6-methyl-1H-pyrimidin-2-one
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

13
Patents

150.07932 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.08660 135.3
[M+Na]+ 173.06854 146.8
[M-H]- 149.07204 139.5
[M+NH4]+ 168.11314 148.8
[M+K]+ 189.04248 142.3
[M+H-H2O]+ 133.07658 127.9
[M+HCOO]- 195.07752 157.0
[M+CH3COO]- 209.09317 176.7
[M+Na-2H]- 171.05399 142.0
[M]+ 150.07877 136.4
[M]- 150.07987 136.4
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