CID 2761150

4-(5-phenyl-1,3,4-oxadiazol-2-yl)piperidine

Structural Information

Molecular Formula
C13H15N3O
SMILES
C1CNCCC1C2=NN=C(O2)C3=CC=CC=C3
InChI
InChI=1S/C13H15N3O/c1-2-4-10(5-3-1)12-15-16-13(17-12)11-6-8-14-9-7-11/h1-5,11,14H,6-9H2
InChIKey
HGVYYGIMDHYGFJ-UHFFFAOYSA-N
Compound name
2-phenyl-5-piperidin-4-yl-1,3,4-oxadiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

100
Patents

229.1215 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.12878 151.2
[M+Na]+ 252.11072 157.0
[M-H]- 228.11422 155.5
[M+NH4]+ 247.15532 164.0
[M+K]+ 268.08466 153.5
[M+H-H2O]+ 212.11876 141.2
[M+HCOO]- 274.11970 167.5
[M+CH3COO]- 288.13535 161.8
[M+Na-2H]- 250.09617 155.6
[M]+ 229.12095 145.9
[M]- 229.12205 145.9
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