CID 825294

1-(2-aminophenyl)pyrrolidine-2,5-dione

Structural Information

Molecular Formula
C10H10N2O2
SMILES
C1CC(=O)N(C1=O)C2=CC=CC=C2N
InChI
InChI=1S/C10H10N2O2/c11-7-3-1-2-4-8(7)12-9(13)5-6-10(12)14/h1-4H,5-6,11H2
InChIKey
AKFYFUDAHYYAPB-UHFFFAOYSA-N
Compound name
1-(2-aminophenyl)pyrrolidine-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

190.07423 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.08151 138.6
[M+Na]+ 213.06345 147.2
[M-H]- 189.06695 144.1
[M+NH4]+ 208.10805 158.2
[M+K]+ 229.03739 144.2
[M+H-H2O]+ 173.07149 131.7
[M+HCOO]- 235.07243 162.2
[M+CH3COO]- 249.08808 183.2
[M+Na-2H]- 211.04890 141.6
[M]+ 190.07368 135.6
[M]- 190.07478 135.6
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