CID 280160

3'-(trifluoromethyl)benzanilide

Structural Information

Molecular Formula
C14H10F3NO
SMILES
C1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C(F)(F)F
InChI
InChI=1S/C14H10F3NO/c15-14(16,17)11-7-4-8-12(9-11)18-13(19)10-5-2-1-3-6-10/h1-9H,(H,18,19)
InChIKey
RGEVOBUFCUKOAC-UHFFFAOYSA-N
Compound name
N-[3-(trifluoromethyl)phenyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

116
Patents

265.07144 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.07872 155.2
[M+Na]+ 288.06066 162.7
[M-H]- 264.06416 158.1
[M+NH4]+ 283.10526 171.1
[M+K]+ 304.03460 158.2
[M+H-H2O]+ 248.06870 145.4
[M+HCOO]- 310.06964 175.3
[M+CH3COO]- 324.08529 197.3
[M+Na-2H]- 286.04611 160.6
[M]+ 265.07089 150.0
[M]- 265.07199 150.0
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