CID 3042605

N-ethyl-2-(m-fluorophenyl)succinimide

Structural Information

Molecular Formula
C12H12FNO2
SMILES
CCN1C(=O)CC(C1=O)C2=CC(=CC=C2)F
InChI
InChI=1S/C12H12FNO2/c1-2-14-11(15)7-10(12(14)16)8-4-3-5-9(13)6-8/h3-6,10H,2,7H2,1H3
InChIKey
ZUWFBBIMPISIPM-UHFFFAOYSA-N
Compound name
1-ethyl-3-(3-fluorophenyl)pyrrolidine-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

221.0852 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.09248 145.3
[M+Na]+ 244.07442 155.0
[M-H]- 220.07792 150.0
[M+NH4]+ 239.11902 164.6
[M+K]+ 260.04836 151.5
[M+H-H2O]+ 204.08246 137.8
[M+HCOO]- 266.08340 166.8
[M+CH3COO]- 280.09905 188.9
[M+Na-2H]- 242.05987 146.7
[M]+ 221.08465 144.1
[M]- 221.08575 144.1
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.