CID 67135863

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

Structural Information

Molecular Formula
C7H11N3O
SMILES
C1CC(CNC1)C2=NC=NO2
InChI
InChI=1S/C7H11N3O/c1-2-6(4-8-3-1)7-9-5-10-11-7/h5-6,8H,1-4H2
InChIKey
LFGAVXRHHARQKL-UHFFFAOYSA-N
Compound name
5-piperidin-3-yl-1,2,4-oxadiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

153.09021 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.097486 131.4
[M+Na]+ 176.079428 137.5
[M-H]- 152.082934 132.5
[M+NH4]+ 171.124033 147.5
[M+K]+ 192.053368 136.4
[M+H-H2O]+ 136.087470 122.8
[M+HCOO]- 198.088411 148.3
[M+CH3COO]- 212.104061 143.2
[M+Na-2H]- 174.064876 137.5
[M]+ 153.08966142 126.2
[M]- 153.09075858 126.2
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