CID 10488013

6-methoxyimidazo[1,2-b]pyridazine-2-carboxylic acid

Structural Information

Molecular Formula
C8H7N3O3
SMILES
COC1=NN2C=C(N=C2C=C1)C(=O)O
InChI
InChI=1S/C8H7N3O3/c1-14-7-3-2-6-9-5(8(12)13)4-11(6)10-7/h2-4H,1H3,(H,12,13)
InChIKey
FUDZICOSKNAQFR-UHFFFAOYSA-N
Compound name
6-methoxyimidazo[1,2-b]pyridazine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

193.04874 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.05602 136.5
[M+Na]+ 216.03796 148.0
[M-H]- 192.04146 137.0
[M+NH4]+ 211.08256 154.4
[M+K]+ 232.01190 145.7
[M+H-H2O]+ 176.04600 129.2
[M+HCOO]- 238.04694 157.9
[M+CH3COO]- 252.06259 179.6
[M+Na-2H]- 214.02341 143.7
[M]+ 193.04819 140.5
[M]- 193.04929 140.5
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

patents stripe