CID 83818820

5-(oxan-4-yl)piperidine-2,4-dione

Structural Information

Molecular Formula
C10H15NO3
SMILES
C1COCCC1C2CNC(=O)CC2=O
InChI
InChI=1S/C10H15NO3/c12-9-5-10(13)11-6-8(9)7-1-3-14-4-2-7/h7-8H,1-6H2,(H,11,13)
InChIKey
DXLXIEYNSPHMCM-UHFFFAOYSA-N
Compound name
5-(oxan-4-yl)piperidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

197.1052 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.11248 143.7
[M+Na]+ 220.09442 147.8
[M-H]- 196.09792 147.1
[M+NH4]+ 215.13902 159.1
[M+K]+ 236.06836 146.5
[M+H-H2O]+ 180.10246 136.5
[M+HCOO]- 242.10340 158.0
[M+CH3COO]- 256.11905 179.2
[M+Na-2H]- 218.07987 146.9
[M]+ 197.10465 135.8
[M]- 197.10575 135.8
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.