CID 62742277

2-cyclopropyl-6-methylpyrimidine-4-carbaldehyde

Structural Information

Molecular Formula
C9H10N2O
SMILES
CC1=CC(=NC(=N1)C2CC2)C=O
InChI
InChI=1S/C9H10N2O/c1-6-4-8(5-12)11-9(10-6)7-2-3-7/h4-5,7H,2-3H2,1H3
InChIKey
CSLVRDRMOPRVCX-UHFFFAOYSA-N
Compound name
2-cyclopropyl-6-methylpyrimidine-4-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

162.07932 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.086596 139.9
[M+Na]+ 185.068538 151.4
[M-H]- 161.072044 145.2
[M+NH4]+ 180.113143 153.5
[M+K]+ 201.042478 147.6
[M+H-H2O]+ 145.076580 131.9
[M+HCOO]- 207.077521 162.7
[M+CH3COO]- 221.093171 182.0
[M+Na-2H]- 183.053986 146.4
[M]+ 162.07877142 143.1
[M]- 162.07986858 143.1
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.