CID 16789139

1-(3-amino-4-fluorophenyl)pyrrolidine-2,5-dione

Structural Information

Molecular Formula
C10H9FN2O2
SMILES
C1CC(=O)N(C1=O)C2=CC(=C(C=C2)F)N
InChI
InChI=1S/C10H9FN2O2/c11-7-2-1-6(5-8(7)12)13-9(14)3-4-10(13)15/h1-2,5H,3-4,12H2
InChIKey
YCZCNWWMOUAKFV-UHFFFAOYSA-N
Compound name
1-(3-amino-4-fluorophenyl)pyrrolidine-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

208.0648 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.07208 144.6
[M+Na]+ 231.05402 155.2
[M+NH4]+ 226.09862 151.4
[M+K]+ 247.02796 151.7
[M-H]- 207.05752 145.8
[M+Na-2H]- 229.03947 149.4
[M]+ 208.06425 146.0
[M]- 208.06535 146.0
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.