CID 302754

N-(4-bromophenyl)-2-(4-chlorophenoxy)acetamide

Structural Information

Molecular Formula
C14H11BrClNO2
SMILES
C1=CC(=CC=C1NC(=O)COC2=CC=C(C=C2)Cl)Br
InChI
InChI=1S/C14H11BrClNO2/c15-10-1-5-12(6-2-10)17-14(18)9-19-13-7-3-11(16)4-8-13/h1-8H,9H2,(H,17,18)
InChIKey
USPQXWOMWBPRCW-UHFFFAOYSA-N
Compound name
N-(4-bromophenyl)-2-(4-chlorophenoxy)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

338.96616 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 339.97344 165.2
[M+Na]+ 361.95538 176.4
[M-H]- 337.95888 174.2
[M+NH4]+ 356.99998 183.0
[M+K]+ 377.92932 163.0
[M+H-H2O]+ 321.96342 164.3
[M+HCOO]- 383.96436 183.1
[M+CH3COO]- 397.98001 205.2
[M+Na-2H]- 359.94083 171.3
[M]+ 338.96561 186.4
[M]- 338.96671 186.4
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

No patent data available for this compound.