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

1
Patents

262.09537 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.10265 157.5
[M+Na]+ 285.08459 163.3
[M-H]- 261.08809 162.3
[M+NH4]+ 280.12919 173.5
[M+K]+ 301.05853 161.3
[M+H-H2O]+ 245.09263 149.7
[M+HCOO]- 307.09357 178.6
[M+CH3COO]- 321.10922 195.8
[M+Na-2H]- 283.07004 157.5
[M]+ 262.09482 156.0
[M]- 262.09592 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