CID 7131370

1212823-28-3

Structural Information

Molecular Formula
C8H10N4
SMILES
C[C@@H](C1=NN=C2N1C=CC=C2)N
InChI
InChI=1S/C8H10N4/c1-6(9)8-11-10-7-4-2-3-5-12(7)8/h2-6H,9H2,1H3/t6-/m0/s1
InChIKey
FQWYAIRHWCMQNP-LURJTMIESA-N
Compound name
(1S)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

162.09055 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.09783 132.2
[M+Na]+ 185.07977 142.4
[M-H]- 161.08327 133.1
[M+NH4]+ 180.12437 151.5
[M+K]+ 201.05371 139.5
[M+H-H2O]+ 145.08781 124.3
[M+HCOO]- 207.08875 154.7
[M+CH3COO]- 221.10440 145.7
[M+Na-2H]- 183.06522 140.1
[M]+ 162.09000 132.4
[M]- 162.09110 132.4
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.