CID 13202146

(+-)-4-(benzoyloxy)-2-oxo-1-pyrrolidineacetamide

Structural Information

Molecular Formula
C13H14N2O4
SMILES
C1C(CN(C1=O)CC(=O)N)OC(=O)C2=CC=CC=C2
InChI
InChI=1S/C13H14N2O4/c14-11(16)8-15-7-10(6-12(15)17)19-13(18)9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H2,14,16)
InChIKey
WHMQYYXMYHNOLL-UHFFFAOYSA-N
Compound name
[1-(2-amino-2-oxoethyl)-5-oxopyrrolidin-3-yl] benzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

262.09537 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.102646 157.5
[M+Na]+ 285.084588 163.3
[M-H]- 261.088094 162.3
[M+NH4]+ 280.129193 173.5
[M+K]+ 301.058528 161.3
[M+H-H2O]+ 245.092630 149.7
[M+HCOO]- 307.093571 178.6
[M+CH3COO]- 321.109221 195.8
[M+Na-2H]- 283.070036 157.5
[M]+ 262.09482142 156.0
[M]- 262.09591858 156.0
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