CID 710651

N-(3-chloro-4-fluorophenyl)-4-methoxybenzamide

Structural Information

Molecular Formula
C14H11ClFNO2
SMILES
COC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)F)Cl
InChI
InChI=1S/C14H11ClFNO2/c1-19-11-5-2-9(3-6-11)14(18)17-10-4-7-13(16)12(15)8-10/h2-8H,1H3,(H,17,18)
InChIKey
SRJQPDFYRJTJHV-UHFFFAOYSA-N
Compound name
N-(3-chloro-4-fluorophenyl)-4-methoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

279.04623 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 280.05351 158.3
[M+Na]+ 302.03545 167.7
[M-H]- 278.03895 164.2
[M+NH4]+ 297.08005 175.1
[M+K]+ 318.00939 162.5
[M+H-H2O]+ 262.04349 150.8
[M+HCOO]- 324.04443 177.8
[M+CH3COO]- 338.06008 200.2
[M+Na-2H]- 300.02090 162.3
[M]+ 279.04568 160.6
[M]- 279.04678 160.6
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

No patent data available for this compound.