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]+ 306.01241 160.3
[M+Na]+ 327.99435 169.5
[M-H]- 303.99785 169.0
[M+NH4]+ 323.03895 178.1
[M+K]+ 343.96829 158.1
[M+H-H2O]+ 288.00239 158.5
[M+HCOO]- 350.00333 182.5
[M+CH3COO]- 364.01898 200.7
[M+Na-2H]- 325.97980 167.4
[M]+ 305.00458 178.9
[M]- 305.00568 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.