CID 43085860

2-[(4-fluorophenyl)amino]propanamide

Structural Information

Molecular Formula
C9H11FN2O
SMILES
CC(C(=O)N)NC1=CC=C(C=C1)F
InChI
InChI=1S/C9H11FN2O/c1-6(9(11)13)12-8-4-2-7(10)3-5-8/h2-6,12H,1H3,(H2,11,13)
InChIKey
VAJZJAWYEXHBCS-UHFFFAOYSA-N
Compound name
2-(4-fluoroanilino)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

182.08554 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.09282 138.0
[M+Na]+ 205.07476 147.3
[M+NH4]+ 200.11936 145.0
[M+K]+ 221.04870 142.6
[M-H]- 181.07826 138.9
[M+Na-2H]- 203.06021 143.3
[M]+ 182.08499 139.1
[M]- 182.08609 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.