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

3
Annotation Hits: 0
References: 33
Patents: 150.07932 Da
Monoisotopic Mass: 0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	151.08660	133.1
[M+Na]+	173.06854	148.0
[M+NH4]+	168.11314	141.6
[M+K]+	189.04248	143.2
[M-H]-	149.07204	141.8
[M+Na-2H]-	171.05399	143.0
[M]+	150.07877	138.7
[M]-	150.07987	138.7

Literature stripe

literature stripe

Patent stripe

patents stripe