CID 171036425

4-methoxy-1-methyl-1h-pyrazole-3-carbaldehyde

Structural Information

Molecular Formula
C6H8N2O2
SMILES
CN1C=C(C(=N1)C=O)OC
InChI
InChI=1S/C6H8N2O2/c1-8-3-6(10-2)5(4-9)7-8/h3-4H,1-2H3
InChIKey
MWMOJHLOEULMOO-UHFFFAOYSA-N
Compound name
4-methoxy-1-methylpyrazole-3-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

140.05858 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.06586 127.0
[M+Na]+ 163.04780 138.9
[M+NH4]+ 158.09240 134.3
[M+K]+ 179.02174 135.7
[M-H]- 139.05130 126.7
[M+Na-2H]- 161.03325 132.2
[M]+ 140.05803 128.4
[M]- 140.05913 128.4
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.