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

6
Patents

162.09055 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.097826 132.2
[M+Na]+ 185.079768 142.4
[M-H]- 161.083274 133.1
[M+NH4]+ 180.124373 151.5
[M+K]+ 201.053708 139.5
[M+H-H2O]+ 145.087810 124.3
[M+HCOO]- 207.088751 154.7
[M+CH3COO]- 221.104401 145.7
[M+Na-2H]- 183.065216 140.1
[M]+ 162.09000142 132.4
[M]- 162.09109858 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.