CID 24212881

3-(2-bromophenyl)-n-phenylpropanamide

Structural Information

Molecular Formula
C15H14BrNO
SMILES
C1=CC=C(C=C1)NC(=O)CCC2=CC=CC=C2Br
InChI
InChI=1S/C15H14BrNO/c16-14-9-5-4-6-12(14)10-11-15(18)17-13-7-2-1-3-8-13/h1-9H,10-11H2,(H,17,18)
InChIKey
KRAWDUJLVJZLGW-UHFFFAOYSA-N
Compound name
3-(2-bromophenyl)-N-phenylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

303.02588 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.03316 159.8
[M+Na]+ 326.01510 164.2
[M+NH4]+ 321.05970 165.0
[M+K]+ 341.98904 162.3
[M-H]- 302.01860 163.2
[M+Na-2H]- 324.00055 165.9
[M]+ 303.02533 160.3
[M]- 303.02643 160.3
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.