CID 11708451

(2e)-3-(2,4-dichlorophenyl)-n-hydroxyacrylamide

Structural Information

Molecular Formula
C9H7Cl2NO2
SMILES
C1=CC(=C(C=C1Cl)Cl)/C=C/C(=O)NO
InChI
InChI=1S/C9H7Cl2NO2/c10-7-3-1-6(8(11)5-7)2-4-9(13)12-14/h1-5,14H,(H,12,13)/b4-2+
InChIKey
LHTLDFWBUPYUDR-DUXPYHPUSA-N
Compound name
(E)-3-(2,4-dichlorophenyl)-N-hydroxyprop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

21
References

44
Patents

230.98538 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.99266 144.4
[M+Na]+ 253.97460 153.9
[M-H]- 229.97810 146.6
[M+NH4]+ 249.01920 163.1
[M+K]+ 269.94854 147.9
[M+H-H2O]+ 213.98264 140.9
[M+HCOO]- 275.98358 158.8
[M+CH3COO]- 289.99923 186.2
[M+Na-2H]- 251.96005 148.5
[M]+ 230.98483 146.3
[M]- 230.98593 146.3
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