CID 165989846

6-cyclopropylpyridazine-3-carboxylic acid

Structural Information

Molecular Formula
C8H8N2O2
SMILES
C1CC1C2=NN=C(C=C2)C(=O)O
InChI
InChI=1S/C8H8N2O2/c11-8(12)7-4-3-6(9-10-7)5-1-2-5/h3-5H,1-2H2,(H,11,12)
InChIKey
BNJYZDKEZYKHLN-UHFFFAOYSA-N
Compound name
6-cyclopropylpyridazine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

164.05858 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.06586 136.8
[M+Na]+ 187.04780 150.7
[M+NH4]+ 182.09240 144.7
[M+K]+ 203.02174 146.9
[M-H]- 163.05130 144.9
[M+Na-2H]- 185.03325 146.1
[M]+ 164.05803 142.0
[M]- 164.05913 142.0
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.