CID 285312

2-chloro-n-[2-(trifluoromethyl)phenyl]benzamide

Structural Information

Molecular Formula
C14H9ClF3NO
SMILES
C1=CC=C(C(=C1)C(=O)NC2=CC=CC=C2C(F)(F)F)Cl
InChI
InChI=1S/C14H9ClF3NO/c15-11-7-3-1-5-9(11)13(20)19-12-8-4-2-6-10(12)14(16,17)18/h1-8H,(H,19,20)
InChIKey
OLOWJXFZJCUUNG-UHFFFAOYSA-N
Compound name
2-chloro-N-[2-(trifluoromethyl)phenyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

299.03247 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 300.03975 160.8
[M+Na]+ 322.02169 170.0
[M-H]- 298.02519 163.9
[M+NH4]+ 317.06629 176.6
[M+K]+ 337.99563 163.7
[M+H-H2O]+ 282.02973 151.8
[M+HCOO]- 344.03067 176.3
[M+CH3COO]- 358.04632 202.1
[M+Na-2H]- 320.00714 165.0
[M]+ 299.03192 158.5
[M]- 299.03302 158.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe