CID 84618192

Ethyl 1-cyclopropyl-4,5-dioxopyrrolidine-3-carboxylate

Structural Information

Molecular Formula
C10H13NO4
SMILES
CCOC(=O)C1CN(C(=O)C1=O)C2CC2
InChI
InChI=1S/C10H13NO4/c1-2-15-10(14)7-5-11(6-3-4-6)9(13)8(7)12/h6-7H,2-5H2,1H3
InChIKey
NWQDPDKTNWFGIV-UHFFFAOYSA-N
Compound name
ethyl 1-cyclopropyl-4,5-dioxopyrrolidine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

211.08446 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.09174 147.5
[M+Na]+ 234.07368 157.4
[M-H]- 210.07718 153.8
[M+NH4]+ 229.11828 162.0
[M+K]+ 250.04762 154.3
[M+H-H2O]+ 194.08172 141.3
[M+HCOO]- 256.08266 168.5
[M+CH3COO]- 270.09831 188.7
[M+Na-2H]- 232.05913 148.0
[M]+ 211.08391 151.3
[M]- 211.08501 151.3
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

No patent data available for this compound.