CID 89148020

3-ethyl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile

Structural Information

Molecular Formula
C9H8N4
SMILES
CCC1=NN=C2N1C=C(C=C2)C#N
InChI
InChI=1S/C9H8N4/c1-2-8-11-12-9-4-3-7(5-10)6-13(8)9/h3-4,6H,2H2,1H3
InChIKey
NOOABIBWCRVZRG-UHFFFAOYSA-N
Compound name
3-ethyl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

172.07489 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.08217 137.7
[M+Na]+ 195.06411 151.5
[M+NH4]+ 190.10871 142.5
[M+K]+ 211.03805 143.1
[M-H]- 171.06761 131.4
[M+Na-2H]- 193.04956 142.0
[M]+ 172.07434 137.1
[M]- 172.07544 137.1
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

patents stripe