CID 21025706

4-(3-methyl-1,2,4-oxadiazol-5-yl)pyridine

Structural Information

Molecular Formula
C8H7N3O
SMILES
CC1=NOC(=N1)C2=CC=NC=C2
InChI
InChI=1S/C8H7N3O/c1-6-10-8(12-11-6)7-2-4-9-5-3-7/h2-5H,1H3
InChIKey
UTDAFKFEIXDFSW-UHFFFAOYSA-N
Compound name
3-methyl-5-pyridin-4-yl-1,2,4-oxadiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

86
Patents

161.05891 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.06619 130.8
[M+Na]+ 184.04813 145.6
[M+NH4]+ 179.09273 138.9
[M+K]+ 200.02207 141.4
[M-H]- 160.05163 134.4
[M+Na-2H]- 182.03358 139.7
[M]+ 161.05836 133.9
[M]- 161.05946 133.9
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