CID 83875355

1551554-37-0

Structural Information

Molecular Formula
C9H12N2O2
SMILES
C1CCN2C(=C(C=N2)CC(=O)O)C1
InChI
InChI=1S/C9H12N2O2/c12-9(13)5-7-6-10-11-4-2-1-3-8(7)11/h6H,1-5H2,(H,12,13)
InChIKey
SQEXEIFPEAOWMI-UHFFFAOYSA-N
Compound name
2-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

180.08987 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.09715 138.4
[M+Na]+ 203.07909 145.5
[M-H]- 179.08259 138.5
[M+NH4]+ 198.12369 157.7
[M+K]+ 219.05303 143.3
[M+H-H2O]+ 163.08713 131.6
[M+HCOO]- 225.08807 156.2
[M+CH3COO]- 239.10372 177.4
[M+Na-2H]- 201.06454 142.8
[M]+ 180.08932 136.1
[M]- 180.09042 136.1
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.