CID 16790276

N-[4-(1-aminoethyl)phenyl]-4-fluorobenzamide

Structural Information

Molecular Formula
C15H15FN2O
SMILES
CC(C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)F)N
InChI
InChI=1S/C15H15FN2O/c1-10(17)11-4-8-14(9-5-11)18-15(19)12-2-6-13(16)7-3-12/h2-10H,17H2,1H3,(H,18,19)
InChIKey
ARVMPEBHNLZTOL-UHFFFAOYSA-N
Compound name
N-[4-(1-aminoethyl)phenyl]-4-fluorobenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

258.11685 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.12413 158.7
[M+Na]+ 281.10607 164.8
[M-H]- 257.10957 163.7
[M+NH4]+ 276.15067 174.4
[M+K]+ 297.08001 160.8
[M+H-H2O]+ 241.11411 150.0
[M+HCOO]- 303.11505 181.5
[M+CH3COO]- 317.13070 201.6
[M+Na-2H]- 279.09152 161.3
[M]+ 258.11630 154.8
[M]- 258.11740 154.8
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