CID 58900

2-(2-hydroxyethylamino)-5-chlorobenzamide

Structural Information

Molecular Formula
C9H11ClN2O2
SMILES
C1=CC(=C(C=C1Cl)C(=O)N)NCCO
InChI
InChI=1S/C9H11ClN2O2/c10-6-1-2-8(12-3-4-13)7(5-6)9(11)14/h1-2,5,12-13H,3-4H2,(H2,11,14)
InChIKey
ARJLAWSLOIDWQW-UHFFFAOYSA-N
Compound name
5-chloro-2-(2-hydroxyethylamino)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

214.0509 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.058176 144.3
[M+Na]+ 237.040118 152.1
[M-H]- 213.043624 146.4
[M+NH4]+ 232.084723 162.5
[M+K]+ 253.014058 147.8
[M+H-H2O]+ 197.048160 139.3
[M+HCOO]- 259.049101 163.9
[M+CH3COO]- 273.064751 188.3
[M+Na-2H]- 235.025566 148.3
[M]+ 214.05035142 144.2
[M]- 214.05144858 144.2
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.