CID 16791567

6-cyclopropyl-1-(1-cyclopropylethyl)-1h-pyrazolo[3,4-b]pyridine-4-carboxylic acid

Structural Information

Molecular Formula
C15H17N3O2
SMILES
CC(C1CC1)N2C3=C(C=N2)C(=CC(=N3)C4CC4)C(=O)O
InChI
InChI=1S/C15H17N3O2/c1-8(9-2-3-9)18-14-12(7-16-18)11(15(19)20)6-13(17-14)10-4-5-10/h6-10H,2-5H2,1H3,(H,19,20)
InChIKey
FUBSOULSLMXLJM-UHFFFAOYSA-N
Compound name
6-cyclopropyl-1-(1-cyclopropylethyl)pyrazolo[3,4-b]pyridine-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

271.13208 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.13936 146.0
[M+Na]+ 294.12130 159.7
[M+NH4]+ 289.16590 153.5
[M+K]+ 310.09524 159.7
[M-H]- 270.12480 160.1
[M+Na-2H]- 292.10675 156.7
[M]+ 271.13153 153.8
[M]- 271.13263 153.8
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