CID 6486603

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

Structural Information

Molecular Formula
C8H13N3O
SMILES
CC1=NOC(=N1)C2CCCNC2
InChI
InChI=1S/C8H13N3O/c1-6-10-8(12-11-6)7-3-2-4-9-5-7/h7,9H,2-5H2,1H3
InChIKey
MPYNENJKQSNBDF-UHFFFAOYSA-N
Compound name
3-methyl-5-piperidin-3-yl-1,2,4-oxadiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

82
Patents

167.10587 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.11315 136.4
[M+Na]+ 190.09509 143.1
[M-H]- 166.09859 137.8
[M+NH4]+ 185.13969 152.3
[M+K]+ 206.06903 141.7
[M+H-H2O]+ 150.10313 128.0
[M+HCOO]- 212.10407 153.0
[M+CH3COO]- 226.11972 148.1
[M+Na-2H]- 188.08054 141.2
[M]+ 167.10532 131.9
[M]- 167.10642 131.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe