CID 14001969

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

Structural Information

Molecular Formula
C10H8FNO2
SMILES
C1C(C(=O)NC1=O)C2=CC=C(C=C2)F
InChI
InChI=1S/C10H8FNO2/c11-7-3-1-6(2-4-7)8-5-9(13)12-10(8)14/h1-4,8H,5H2,(H,12,13,14)
InChIKey
TXFBLEPUUKYKDS-UHFFFAOYSA-N
Compound name
3-(4-fluorophenyl)pyrrolidine-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

193.05391 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.06119 141.9
[M+Na]+ 216.04313 153.2
[M+NH4]+ 211.08773 149.0
[M+K]+ 232.01707 149.0
[M-H]- 192.04663 142.4
[M+Na-2H]- 214.02858 147.0
[M]+ 193.05336 143.3
[M]- 193.05446 143.3
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.