CID 531810

N-(4-bromophenyl)-3-(trifluoromethyl)benzamide

Structural Information

Molecular Formula
C14H9BrF3NO
SMILES
C1=CC(=CC(=C1)C(F)(F)F)C(=O)NC2=CC=C(C=C2)Br
InChI
InChI=1S/C14H9BrF3NO/c15-11-4-6-12(7-5-11)19-13(20)9-2-1-3-10(8-9)14(16,17)18/h1-8H,(H,19,20)
InChIKey
JDUHFWWSDVISOZ-UHFFFAOYSA-N
Compound name
N-(4-bromophenyl)-3-(trifluoromethyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

342.98196 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.98924 172.8
[M+Na]+ 365.97118 174.7
[M+NH4]+ 361.01578 175.4
[M+K]+ 381.94512 173.8
[M-H]- 341.97468 171.3
[M+Na-2H]- 363.95663 175.8
[M]+ 342.98141 171.5
[M]- 342.98251 171.5
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