CID 84460

14464-29-0

Structural Information

Molecular Formula
C6H7NO4
SMILES
CC(=O)ON1C(=O)CCC1=O
InChI
InChI=1S/C6H7NO4/c1-4(8)11-7-5(9)2-3-6(7)10/h2-3H2,1H3
InChIKey
SIFCHNIAAPMMKG-UHFFFAOYSA-N
Compound name
(2,5-dioxopyrrolidin-1-yl) acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

3710
Patents

157.0375 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.04478 131.1
[M+Na]+ 180.02672 140.2
[M+NH4]+ 175.07132 137.3
[M+K]+ 196.00066 138.7
[M-H]- 156.03022 129.5
[M+Na-2H]- 178.01217 133.3
[M]+ 157.03695 131.4
[M]- 157.03805 131.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.