CID 91360113

3-(oxan-4-yl)piperidin-2-one

Structural Information

Molecular Formula
C10H17NO2
SMILES
C1CC(C(=O)NC1)C2CCOCC2
InChI
InChI=1S/C10H17NO2/c12-10-9(2-1-5-11-10)8-3-6-13-7-4-8/h8-9H,1-7H2,(H,11,12)
InChIKey
IVMKMPVENPOXGI-UHFFFAOYSA-N
Compound name
3-(oxan-4-yl)piperidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

183.12593 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.13321 143.0
[M+Na]+ 206.11515 153.3
[M+NH4]+ 201.15975 151.2
[M+K]+ 222.08909 147.6
[M-H]- 182.11865 146.9
[M+Na-2H]- 204.10060 147.4
[M]+ 183.12538 145.2
[M]- 183.12648 145.2
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