CID 21952856

4,5,6,7-tetrahydro-1h-pyrazolo[3,4-c]pyridine

Structural Information

Molecular Formula
C6H9N3
SMILES
C1CNCC2=C1C=NN2
InChI
InChI=1S/C6H9N3/c1-2-7-4-6-5(1)3-8-9-6/h3,7H,1-2,4H2,(H,8,9)
InChIKey
KFOAQYYCEAGMEF-UHFFFAOYSA-N
Compound name
4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

535
Patents

123.07965 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 124.08693 124.7
[M+Na]+ 146.06887 135.6
[M+NH4]+ 141.11347 133.0
[M+K]+ 162.04281 131.7
[M-H]- 122.07237 124.4
[M+Na-2H]- 144.05432 129.4
[M]+ 123.07910 125.8
[M]- 123.08020 125.8
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