CID 13011721

Pyridazine-4-carbaldehyde

Structural Information

Molecular Formula
C5H4N2O
SMILES
C1=CN=NC=C1C=O
InChI
InChI=1S/C5H4N2O/c8-4-5-1-2-6-7-3-5/h1-4H
InChIKey
BZORCBQGFKOHMY-UHFFFAOYSA-N
Compound name
pyridazine-4-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

573
Patents

108.032364 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 109.03964 117.6
[M+Na]+ 131.02158 131.6
[M+NH4]+ 126.06619 126.0
[M+K]+ 146.99552 125.3
[M-H]- 107.02509 118.7
[M+Na-2H]- 129.00703 126.0
[M]+ 108.03182 119.8
[M]- 108.03291 119.8
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