CID 145874805

6-cyclopropyl-5-methoxypyridazine-3-carboxylic acid hydrochloride

Structural Information

Molecular Formula
C9H10N2O3
SMILES
COC1=CC(=NN=C1C2CC2)C(=O)O
InChI
InChI=1S/C9H10N2O3/c1-14-7-4-6(9(12)13)10-11-8(7)5-2-3-5/h4-5H,2-3H2,1H3,(H,12,13)
InChIKey
HNNBZTKVAHBTMB-UHFFFAOYSA-N
Compound name
6-cyclopropyl-5-methoxypyridazine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.06914 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.076416 145.6
[M+Na]+ 217.058358 156.2
[M-H]- 193.061864 149.7
[M+NH4]+ 212.102963 157.1
[M+K]+ 233.032298 152.6
[M+H-H2O]+ 177.066400 137.9
[M+HCOO]- 239.067341 166.4
[M+CH3COO]- 253.082991 184.3
[M+Na-2H]- 215.043806 150.6
[M]+ 194.06859142 149.3
[M]- 194.06968858 149.3
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.