CID 2760583

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

Structural Information

Molecular Formula
C6H9N3
SMILES
C1CNCC2=C1NN=C2
InChI
InChI=1S/C6H9N3/c1-2-7-3-5-4-8-9-6(1)5/h4,7H,1-3H2,(H,8,9)
InChIKey
VGMJQHONPAXABH-UHFFFAOYSA-N
Compound name
4,5,6,7-tetrahydro-1H-pyrazolo[4,5-c]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

1144
Patents

123.07965 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 124.086926 124.7
[M+Na]+ 146.068868 132.0
[M-H]- 122.072374 121.9
[M+NH4]+ 141.113473 144.1
[M+K]+ 162.042808 128.6
[M+H-H2O]+ 106.076910 117.4
[M+HCOO]- 168.077851 141.0
[M+CH3COO]- 182.093501 136.5
[M+Na-2H]- 144.054316 131.8
[M]+ 123.07910142 118.0
[M]- 123.08019858 118.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe