CID 19898178

6-methylpiperidine-2,4-dione

Structural Information

Molecular Formula
C6H9NO2
SMILES
CC1CC(=O)CC(=O)N1
InChI
InChI=1S/C6H9NO2/c1-4-2-5(8)3-6(9)7-4/h4H,2-3H2,1H3,(H,7,9)
InChIKey
ANAIVIDMOFUACM-UHFFFAOYSA-N
Compound name
6-methylpiperidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

42
Patents

127.06333 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.07061 123.9
[M+Na]+ 150.05255 131.5
[M-H]- 126.05605 124.7
[M+NH4]+ 145.09715 144.2
[M+K]+ 166.02649 129.9
[M+H-H2O]+ 110.06059 118.6
[M+HCOO]- 172.06153 143.1
[M+CH3COO]- 186.07718 167.8
[M+Na-2H]- 148.03800 128.9
[M]+ 127.06278 119.3
[M]- 127.06388 119.3
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

patents stripe