CID 135636134

Ethyl 2-ethyl-6-oxo-6,7-dihydro-2h-pyrazolo[3,4-b]pyridine-4-carboxylate

Structural Information

Molecular Formula
C11H13N3O3
SMILES
CCN1C=C2C(=CC(=O)NC2=N1)C(=O)OCC
InChI
InChI=1S/C11H13N3O3/c1-3-14-6-8-7(11(16)17-4-2)5-9(15)12-10(8)13-14/h5-6H,3-4H2,1-2H3,(H,12,13,15)
InChIKey
IBCHTHBBPLADMG-UHFFFAOYSA-N
Compound name
ethyl 2-ethyl-6-oxo-7H-pyrazolo[3,4-b]pyridine-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

235.09569 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.10297 151.0
[M+Na]+ 258.08491 163.6
[M+NH4]+ 253.12951 156.6
[M+K]+ 274.05885 160.5
[M-H]- 234.08841 149.6
[M+Na-2H]- 256.07036 155.0
[M]+ 235.09514 152.1
[M]- 235.09624 152.1
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.

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No patent data available for this compound.