CID 981216

2-(2,4-dibromophenoxy)-n-(3-hydroxyphenyl)acetamide

Structural Information

Molecular Formula
C14H11Br2NO3
SMILES
C1=CC(=CC(=C1)O)NC(=O)COC2=C(C=C(C=C2)Br)Br
InChI
InChI=1S/C14H11Br2NO3/c15-9-4-5-13(12(16)6-9)20-8-14(19)17-10-2-1-3-11(18)7-10/h1-7,18H,8H2,(H,17,19)
InChIKey
YLKZPXISJIEBOP-UHFFFAOYSA-N
Compound name
2-(2,4-dibromophenoxy)-N-(3-hydroxyphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

398.91058 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 399.91786 164.0
[M+Na]+ 421.89980 172.6
[M-H]- 397.90330 171.7
[M+NH4]+ 416.94440 178.6
[M+K]+ 437.87374 156.9
[M+H-H2O]+ 381.90784 170.0
[M+HCOO]- 443.90878 179.2
[M+CH3COO]- 457.92443 216.6
[M+Na-2H]- 419.88525 168.8
[M]+ 398.91003 197.9
[M]- 398.91113 197.9
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.