CID 673830

303091-97-6

Structural Information

Molecular Formula
C15H13ClFNO
SMILES
C1=CC=C(C(=C1)C(=O)NCCC2=CC=C(C=C2)Cl)F
InChI
InChI=1S/C15H13ClFNO/c16-12-7-5-11(6-8-12)9-10-18-15(19)13-3-1-2-4-14(13)17/h1-8H,9-10H2,(H,18,19)
InChIKey
JYPRNHSXNAXVCW-UHFFFAOYSA-N
Compound name
N-[2-(4-chlorophenyl)ethyl]-2-fluorobenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

277.06696 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.074236 160.2
[M+Na]+ 300.056178 168.3
[M-H]- 276.059684 165.4
[M+NH4]+ 295.100783 176.8
[M+K]+ 316.030118 162.2
[M+H-H2O]+ 260.064220 152.5
[M+HCOO]- 322.065161 179.1
[M+CH3COO]- 336.080811 199.9
[M+Na-2H]- 298.041626 164.3
[M]+ 277.06641142 161.0
[M]- 277.06750858 161.0
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.