CID 79515719

1-(4-fluoro-2-methylphenyl)pyrrolidine-2,4-dione

Structural Information

Molecular Formula
C11H10FNO2
SMILES
CC1=C(C=CC(=C1)F)N2CC(=O)CC2=O
InChI
InChI=1S/C11H10FNO2/c1-7-4-8(12)2-3-10(7)13-6-9(14)5-11(13)15/h2-4H,5-6H2,1H3
InChIKey
ABEPVGVFAULIBV-UHFFFAOYSA-N
Compound name
1-(4-fluoro-2-methylphenyl)pyrrolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

207.06955 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.07683 140.6
[M+Na]+ 230.05877 150.7
[M-H]- 206.06227 145.5
[M+NH4]+ 225.10337 160.5
[M+K]+ 246.03271 147.5
[M+H-H2O]+ 190.06681 133.3
[M+HCOO]- 252.06775 162.4
[M+CH3COO]- 266.08340 185.9
[M+Na-2H]- 228.04422 142.5
[M]+ 207.06900 139.1
[M]- 207.07010 139.1
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.