CID 58592978

3,3-dimethylpiperidine-2,4-dione

Structural Information

Molecular Formula
C7H11NO2
SMILES
CC1(C(=O)CCNC1=O)C
InChI
InChI=1S/C7H11NO2/c1-7(2)5(9)3-4-8-6(7)10/h3-4H2,1-2H3,(H,8,10)
InChIKey
VXJPHMNYLXKYRP-UHFFFAOYSA-N
Compound name
3,3-dimethylpiperidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

141.07898 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.08626 129.7
[M+Na]+ 164.06820 140.6
[M+NH4]+ 159.11280 138.7
[M+K]+ 180.04214 133.7
[M-H]- 140.07170 129.9
[M+Na-2H]- 162.05365 135.2
[M]+ 141.07843 131.2
[M]- 141.07953 131.2
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