CID 24950192

5-(piperidin-4-yl)-2,3-dihydro-1,3,4-oxadiazol-2-one hydrochloride

Structural Information

Molecular Formula
C7H11N3O2
SMILES
C1CNCCC1C2=NNC(=O)O2
InChI
InChI=1S/C7H11N3O2/c11-7-10-9-6(12-7)5-1-3-8-4-2-5/h5,8H,1-4H2,(H,10,11)
InChIKey
QMIAMKPZGHFEJM-UHFFFAOYSA-N
Compound name
5-piperidin-4-yl-3H-1,3,4-oxadiazol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

43
Patents

169.08513 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.09241 135.0
[M+Na]+ 192.07435 141.8
[M-H]- 168.07785 135.2
[M+NH4]+ 187.11895 149.9
[M+K]+ 208.04829 139.6
[M+H-H2O]+ 152.08239 126.8
[M+HCOO]- 214.08333 150.7
[M+CH3COO]- 228.09898 146.3
[M+Na-2H]- 190.05980 139.8
[M]+ 169.08458 129.0
[M]- 169.08568 129.0
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