CID 2735988

N-(2,4-dichloro-5-hydroxyphenyl)acetamide

Structural Information

Molecular Formula
C8H7Cl2NO2
SMILES
CC(=O)NC1=CC(=C(C=C1Cl)Cl)O
InChI
InChI=1S/C8H7Cl2NO2/c1-4(12)11-7-3-8(13)6(10)2-5(7)9/h2-3,13H,1H3,(H,11,12)
InChIKey
KKTTWHOBHAIWDY-UHFFFAOYSA-N
Compound name
N-(2,4-dichloro-5-hydroxyphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

44
Patents

218.98538 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.99266 140.1
[M+Na]+ 241.97460 150.6
[M-H]- 217.97810 142.7
[M+NH4]+ 237.01920 159.6
[M+K]+ 257.94854 145.5
[M+H-H2O]+ 201.98264 137.0
[M+HCOO]- 263.98358 154.6
[M+CH3COO]- 277.99923 186.0
[M+Na-2H]- 239.96005 144.1
[M]+ 218.98483 142.7
[M]- 218.98593 142.7
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

patents stripe