CID 59133049

939412-81-4

Structural Information

Molecular Formula
C9H9NO5
SMILES
C1CC(=O)N(C1=O)OC(=O)C2CC(=O)C2
InChI
InChI=1S/C9H9NO5/c11-6-3-5(4-6)9(14)15-10-7(12)1-2-8(10)13/h5H,1-4H2
InChIKey
YSSHHKYKCKPLCN-UHFFFAOYSA-N
Compound name
(2,5-dioxopyrrolidin-1-yl) 3-oxocyclobutane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

46
Patents

211.04807 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.05535 147.1
[M+Na]+ 234.03729 151.0
[M+NH4]+ 229.08189 148.5
[M+K]+ 250.01123 151.6
[M-H]- 210.04079 143.4
[M+Na-2H]- 232.02274 146.2
[M]+ 211.04752 144.8
[M]- 211.04862 144.8
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