CID 22147664

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

Structural Information

Molecular Formula
C13H15N3O
SMILES
C1CCNC(C1)C2=NC(=NO2)C3=CC=CC=C3
InChI
InChI=1S/C13H15N3O/c1-2-6-10(7-3-1)12-15-13(17-16-12)11-8-4-5-9-14-11/h1-3,6-7,11,14H,4-5,8-9H2
InChIKey
DELWBQUNMJKVQW-UHFFFAOYSA-N
Compound name
3-phenyl-5-piperidin-2-yl-1,2,4-oxadiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

229.1215 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.12878 152.7
[M+Na]+ 252.11072 166.2
[M+NH4]+ 247.15532 160.7
[M+K]+ 268.08466 161.3
[M-H]- 228.11422 158.0
[M+Na-2H]- 250.09617 161.0
[M]+ 229.12095 156.0
[M]- 229.12205 156.0
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