CID 11788855

135544-68-2

Structural Information

Molecular Formula
C8H9NO5
SMILES
C=CCOC(=O)ON1C(=O)CCC1=O
InChI
InChI=1S/C8H9NO5/c1-2-5-13-8(12)14-9-6(10)3-4-7(9)11/h2H,1,3-5H2
InChIKey
OIXALTPBNZNFLJ-UHFFFAOYSA-N
Compound name
(2,5-dioxopyrrolidin-1-yl) prop-2-enyl carbonate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

347
Patents

199.04807 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.055346 137.9
[M+Na]+ 222.037288 146.1
[M-H]- 198.040794 140.2
[M+NH4]+ 217.081893 157.5
[M+K]+ 238.011228 145.7
[M+H-H2O]+ 182.045330 132.1
[M+HCOO]- 244.046271 160.2
[M+CH3COO]- 258.061921 180.4
[M+Na-2H]- 220.022736 140.2
[M]+ 199.04752142 140.2
[M]- 199.04861858 140.2
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