CID 52191385

1-(4-amino-2-fluorophenyl)pyrrolidin-2-one

Structural Information

Molecular Formula
C10H11FN2O
SMILES
C1CC(=O)N(C1)C2=C(C=C(C=C2)N)F
InChI
InChI=1S/C10H11FN2O/c11-8-6-7(12)3-4-9(8)13-5-1-2-10(13)14/h3-4,6H,1-2,5,12H2
InChIKey
MEBCVJIICUSZKK-UHFFFAOYSA-N
Compound name
1-(4-amino-2-fluorophenyl)pyrrolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

68
Patents

194.08554 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.09282 141.9
[M+Na]+ 217.07476 152.6
[M+NH4]+ 212.11936 149.6
[M+K]+ 233.04870 148.5
[M-H]- 193.07826 143.8
[M+Na-2H]- 215.06021 147.6
[M]+ 194.08499 143.6
[M]- 194.08609 143.6
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