CID 986635

N-(4-bromo-3-methylphenyl)biphenyl-4-carboxamide

Structural Information

Molecular Formula
C20H16BrNO
SMILES
CC1=C(C=CC(=C1)NC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)Br
InChI
InChI=1S/C20H16BrNO/c1-14-13-18(11-12-19(14)21)22-20(23)17-9-7-16(8-10-17)15-5-3-2-4-6-15/h2-13H,1H3,(H,22,23)
InChIKey
NPVOIWXJADODFV-UHFFFAOYSA-N
Compound name
N-(4-bromo-3-methylphenyl)-4-phenylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

365.04153 Da
Monoisotopic Mass

6.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 366.04881 179.5
[M+Na]+ 388.03075 188.9
[M-H]- 364.03425 191.2
[M+NH4]+ 383.07535 195.0
[M+K]+ 404.00469 176.0
[M+H-H2O]+ 348.03879 176.9
[M+HCOO]- 410.03973 200.7
[M+CH3COO]- 424.05538 192.2
[M+Na-2H]- 386.01620 184.3
[M]+ 365.04098 196.9
[M]- 365.04208 196.9
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.