CID 123725403

5-(methoxycarbonyl)pyrazolo[1,5-a]pyridine-3-carboxylic acid

Structural Information

Molecular Formula
C10H8N2O4
SMILES
COC(=O)C1=CC2=C(C=NN2C=C1)C(=O)O
InChI
InChI=1S/C10H8N2O4/c1-16-10(15)6-2-3-12-8(4-6)7(5-11-12)9(13)14/h2-5H,1H3,(H,13,14)
InChIKey
WEOCGDKAUXFPDP-UHFFFAOYSA-N
Compound name
5-methoxycarbonylpyrazolo[1,5-a]pyridine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

220.0484 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.055676 143.1
[M+Na]+ 243.037618 153.5
[M-H]- 219.041124 144.8
[M+NH4]+ 238.082223 161.1
[M+K]+ 259.011558 151.5
[M+H-H2O]+ 203.045660 136.4
[M+HCOO]- 265.046601 164.5
[M+CH3COO]- 279.062251 184.3
[M+Na-2H]- 241.023066 148.3
[M]+ 220.04785142 147.3
[M]- 220.04894858 147.3
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