CID 145913278

[3-(1h-pyrazol-3-yl)pyridin-4-yl]methanamine trihydrochloride

Structural Information

Molecular Formula
C9H10N4
SMILES
C1=CN=CC(=C1CN)C2=CC=NN2
InChI
InChI=1S/C9H10N4/c10-5-7-1-3-11-6-8(7)9-2-4-12-13-9/h1-4,6H,5,10H2,(H,12,13)
InChIKey
GKNPVCYAIIVADM-UHFFFAOYSA-N
Compound name
[3-(1H-pyrazol-5-yl)pyridin-4-yl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

174.09055 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.09783 135.8
[M+Na]+ 197.07977 144.3
[M-H]- 173.08327 137.1
[M+NH4]+ 192.12437 152.4
[M+K]+ 213.05371 140.0
[M+H-H2O]+ 157.08781 127.1
[M+HCOO]- 219.08875 157.6
[M+CH3COO]- 233.10440 148.1
[M+Na-2H]- 195.06522 142.3
[M]+ 174.09000 132.3
[M]- 174.09110 132.3
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

No patent data available for this compound.