CID 302755

N-(4-bromophenyl)-2-phenoxyacetamide

Structural Information

Molecular Formula
C14H12BrNO2
SMILES
C1=CC=C(C=C1)OCC(=O)NC2=CC=C(C=C2)Br
InChI
InChI=1S/C14H12BrNO2/c15-11-6-8-12(9-7-11)16-14(17)10-18-13-4-2-1-3-5-13/h1-9H,10H2,(H,16,17)
InChIKey
YZCYBBRYOXKJGX-UHFFFAOYSA-N
Compound name
N-(4-bromophenyl)-2-phenoxyacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

305.00513 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.012406 160.3
[M+Na]+ 327.994348 169.5
[M-H]- 303.997854 169.0
[M+NH4]+ 323.038953 178.1
[M+K]+ 343.968288 158.1
[M+H-H2O]+ 288.002390 158.5
[M+HCOO]- 350.003331 182.5
[M+CH3COO]- 364.018981 200.7
[M+Na-2H]- 325.979796 167.4
[M]+ 305.00458142 178.9
[M]- 305.00567858 178.9
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.