CID 82468041

5-(piperidin-3-yl)-1,3,4-oxadiazol-2-amine dihydrochloride

Structural Information

Molecular Formula
C7H12N4O
SMILES
C1CC(CNC1)C2=NN=C(O2)N
InChI
InChI=1S/C7H12N4O/c8-7-11-10-6(12-7)5-2-1-3-9-4-5/h5,9H,1-4H2,(H2,8,11)
InChIKey
FMTKZODDFPDVLH-UHFFFAOYSA-N
Compound name
5-piperidin-3-yl-1,3,4-oxadiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

168.1011 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.108376 135.8
[M+Na]+ 191.090318 142.0
[M-H]- 167.093824 136.8
[M+NH4]+ 186.134923 151.0
[M+K]+ 207.064258 140.3
[M+H-H2O]+ 151.098360 127.1
[M+HCOO]- 213.099301 153.1
[M+CH3COO]- 227.114951 147.1
[M+Na-2H]- 189.075766 140.6
[M]+ 168.10055142 129.3
[M]- 168.10164858 129.3
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

No patent data available for this compound.