CID 82396726

Methyl 5-formylpyrazolo[1,5-a]pyridine-3-carboxylate

Structural Information

Molecular Formula
C10H8N2O3
SMILES
COC(=O)C1=C2C=C(C=CN2N=C1)C=O
InChI
InChI=1S/C10H8N2O3/c1-15-10(14)8-5-11-12-3-2-7(6-13)4-9(8)12/h2-6H,1H3
InChIKey
AHPBXOYVKDTSQN-UHFFFAOYSA-N
Compound name
methyl 5-formylpyrazolo[1,5-a]pyridine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

204.0535 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.06078 139.7
[M+Na]+ 227.04272 151.1
[M-H]- 203.04622 142.7
[M+NH4]+ 222.08732 159.2
[M+K]+ 243.01666 148.8
[M+H-H2O]+ 187.05076 132.7
[M+HCOO]- 249.05170 163.5
[M+CH3COO]- 263.06735 183.7
[M+Na-2H]- 225.02817 146.4
[M]+ 204.05295 144.9
[M]- 204.05405 144.9
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