CID 21942204

Tert-butyl 3,5-dioxopiperidine-1-carboxylate

Structural Information

Molecular Formula
C10H15NO4
SMILES
CC(C)(C)OC(=O)N1CC(=O)CC(=O)C1
InChI
InChI=1S/C10H15NO4/c1-10(2,3)15-9(14)11-5-7(12)4-8(13)6-11/h4-6H2,1-3H3
InChIKey
KWNDKZADLGFSKE-UHFFFAOYSA-N
Compound name
tert-butyl 3,5-dioxopiperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

164
Patents

213.10011 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.107386 144.9
[M+Na]+ 236.089328 151.8
[M-H]- 212.092834 147.1
[M+NH4]+ 231.133933 162.6
[M+K]+ 252.063268 151.6
[M+H-H2O]+ 196.097370 139.3
[M+HCOO]- 258.098311 162.5
[M+CH3COO]- 272.113961 185.2
[M+Na-2H]- 234.074776 148.3
[M]+ 213.09956142 144.7
[M]- 213.10065858 144.7
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