CID 3050264

2-(2,4-dimethoxyphenyl)-n-methylsuccinimide

Structural Information

Molecular Formula
C13H15NO4
SMILES
CN1C(=O)CC(C1=O)C2=C(C=C(C=C2)OC)OC
InChI
InChI=1S/C13H15NO4/c1-14-12(15)7-10(13(14)16)9-5-4-8(17-2)6-11(9)18-3/h4-6,10H,7H2,1-3H3
InChIKey
PNOVYOUZFAIAIU-UHFFFAOYSA-N
Compound name
3-(2,4-dimethoxyphenyl)-1-methylpyrrolidine-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

249.10011 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.10739 152.2
[M+Na]+ 272.08933 162.0
[M-H]- 248.09283 158.5
[M+NH4]+ 267.13393 170.5
[M+K]+ 288.06327 159.9
[M+H-H2O]+ 232.09737 145.5
[M+HCOO]- 294.09831 174.7
[M+CH3COO]- 308.11396 194.8
[M+Na-2H]- 270.07478 153.2
[M]+ 249.09956 155.7
[M]- 249.10066 155.7
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.