CID 51072209

Tert-butyl 2,2-dimethyl-3-oxopyrrolidine-1-carboxylate

Structural Information

Molecular Formula
C11H19NO3
SMILES
CC1(C(=O)CCN1C(=O)OC(C)(C)C)C
InChI
InChI=1S/C11H19NO3/c1-10(2,3)15-9(14)12-7-6-8(13)11(12,4)5/h6-7H2,1-5H3
InChIKey
HCBZLIKTIBTGNK-UHFFFAOYSA-N
Compound name
tert-butyl 2,2-dimethyl-3-oxopyrrolidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

213.13649 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.14377 146.8
[M+Na]+ 236.12571 154.9
[M-H]- 212.12921 149.4
[M+NH4]+ 231.17031 168.6
[M+K]+ 252.09965 154.6
[M+H-H2O]+ 196.13375 142.8
[M+HCOO]- 258.13469 165.8
[M+CH3COO]- 272.15034 186.1
[M+Na-2H]- 234.11116 149.8
[M]+ 213.13594 148.5
[M]- 213.13704 148.5
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