CID 3584864

1-(2,4-dimethoxyphenyl)pyrrolidine-2,5-dione

Structural Information

Molecular Formula
C12H13NO4
SMILES
COC1=CC(=C(C=C1)N2C(=O)CCC2=O)OC
InChI
InChI=1S/C12H13NO4/c1-16-8-3-4-9(10(7-8)17-2)13-11(14)5-6-12(13)15/h3-4,7H,5-6H2,1-2H3
InChIKey
ARGFKAVRWPWYKE-UHFFFAOYSA-N
Compound name
1-(2,4-dimethoxyphenyl)pyrrolidine-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

235.08446 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.09174 151.1
[M+Na]+ 258.07368 163.0
[M+NH4]+ 253.11828 158.0
[M+K]+ 274.04762 159.5
[M-H]- 234.07718 152.8
[M+Na-2H]- 256.05913 156.2
[M]+ 235.08391 153.0
[M]- 235.08501 153.0
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.