CID 137025538

6-(cyclopropylmethyl)pyrimidin-4-ol

Structural Information

Molecular Formula
C8H10N2O
SMILES
C1CC1CC2=CC(=O)NC=N2
InChI
InChI=1S/C8H10N2O/c11-8-4-7(9-5-10-8)3-6-1-2-6/h4-6H,1-3H2,(H,9,10,11)
InChIKey
VAKAPIBNLGYHPC-UHFFFAOYSA-N
Compound name
4-(cyclopropylmethyl)-1H-pyrimidin-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

150.07932 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.086596 135.3
[M+Na]+ 173.068538 145.9
[M-H]- 149.072044 139.1
[M+NH4]+ 168.113143 148.5
[M+K]+ 189.042478 141.6
[M+H-H2O]+ 133.076580 127.6
[M+HCOO]- 195.077521 157.1
[M+CH3COO]- 209.093171 175.6
[M+Na-2H]- 171.053986 142.7
[M]+ 150.07877142 136.1
[M]- 150.07986858 136.1
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.