CID 146178222

Tert-butyl (2r)-2-methyl-4,6-dioxopiperidine-1-carboxylate

Structural Information

Molecular Formula
C11H17NO4
SMILES
C[C@@H]1CC(=O)CC(=O)N1C(=O)OC(C)(C)C
InChI
InChI=1S/C11H17NO4/c1-7-5-8(13)6-9(14)12(7)10(15)16-11(2,3)4/h7H,5-6H2,1-4H3/t7-/m1/s1
InChIKey
UAPGGOOREDFMCD-SSDOTTSWSA-N
Compound name
tert-butyl (2R)-2-methyl-4,6-dioxopiperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

227.11575 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.12303 148.4
[M+Na]+ 250.10497 155.9
[M-H]- 226.10847 150.8
[M+NH4]+ 245.14957 165.9
[M+K]+ 266.07891 155.4
[M+H-H2O]+ 210.11301 143.0
[M+HCOO]- 272.11395 165.7
[M+CH3COO]- 286.12960 189.5
[M+Na-2H]- 248.09042 150.8
[M]+ 227.11520 149.0
[M]- 227.11630 149.0
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