CID 82555194

2375273-85-9

Structural Information

Molecular Formula
C7H9N5
SMILES
C1=CN2C(=NC(=N2)N)C=C1CN
InChI
InChI=1S/C7H9N5/c8-4-5-1-2-12-6(3-5)10-7(9)11-12/h1-3H,4,8H2,(H2,9,11)
InChIKey
VODXRTKWHKJOBR-UHFFFAOYSA-N
Compound name
7-(aminomethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

163.0858 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.09308 130.2
[M+Na]+ 186.07502 142.3
[M+NH4]+ 181.11962 137.9
[M+K]+ 202.04896 138.8
[M-H]- 162.07852 131.7
[M+Na-2H]- 184.06047 136.6
[M]+ 163.08525 132.0
[M]- 163.08635 132.0
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.