CID 86767699

6-chloro-3-cyclopropyl-1h-pyrazolo[3,4-b]pyridine

Structural Information

Molecular Formula
C9H8ClN3
SMILES
C1CC1C2=C3C=CC(=NC3=NN2)Cl
InChI
InChI=1S/C9H8ClN3/c10-7-4-3-6-8(5-1-2-5)12-13-9(6)11-7/h3-5H,1-2H2,(H,11,12,13)
InChIKey
MSOHKODTXOXXEB-UHFFFAOYSA-N
Compound name
6-chloro-3-cyclopropyl-2H-pyrazolo[3,4-b]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

193.04068 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.04796 139.7
[M+Na]+ 216.02990 156.5
[M+NH4]+ 211.07450 149.4
[M+K]+ 232.00384 151.8
[M-H]- 192.03340 148.8
[M+Na-2H]- 214.01535 150.0
[M]+ 193.04013 146.1
[M]- 193.04123 146.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.