CID 186076

2,6-dichloro-3-hydroxybenzamide

Structural Information

Molecular Formula
C7H5Cl2NO2
SMILES
C1=CC(=C(C(=C1O)Cl)C(=O)N)Cl
InChI
InChI=1S/C7H5Cl2NO2/c8-3-1-2-4(11)6(9)5(3)7(10)12/h1-2,11H,(H2,10,12)
InChIKey
WCSKGUMNEYMMBE-UHFFFAOYSA-N
Compound name
2,6-dichloro-3-hydroxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

204.96973 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.97701 135.8
[M+Na]+ 227.95895 146.6
[M-H]- 203.96245 138.0
[M+NH4]+ 223.00355 155.4
[M+K]+ 243.93289 141.4
[M+H-H2O]+ 187.96699 132.9
[M+HCOO]- 249.96793 150.0
[M+CH3COO]- 263.98358 183.1
[M+Na-2H]- 225.94440 139.3
[M]+ 204.96918 137.1
[M]- 204.97028 137.1
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.