CID 3060087

77694-43-0

Structural Information

Molecular Formula
C10H13NO4
SMILES
CC1(CC(C(=O)O1)N2C(=O)CCC2=O)C
InChI
InChI=1S/C10H13NO4/c1-10(2)5-6(9(14)15-10)11-7(12)3-4-8(11)13/h6H,3-5H2,1-2H3
InChIKey
ZICJNBJSTOSWKM-UHFFFAOYSA-N
Compound name
1-(5,5-dimethyl-2-oxooxolan-3-yl)pyrrolidine-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

211.08446 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.09174 140.8
[M+Na]+ 234.07368 150.0
[M-H]- 210.07718 147.4
[M+NH4]+ 229.11828 162.7
[M+K]+ 250.04762 149.6
[M+H-H2O]+ 194.08172 136.7
[M+HCOO]- 256.08266 161.4
[M+CH3COO]- 270.09831 184.4
[M+Na-2H]- 232.05913 142.2
[M]+ 211.08391 141.0
[M]- 211.08501 141.0
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

No patent data available for this compound.