CID 135643518

2-(2-(5-bromo-2-hydroxybenzylidene)hydrazino)-n-(2-chlorophenyl)-2-oxoacetamide

Structural Information

Molecular Formula
C15H11BrClN3O3
SMILES
C1=CC=C(C(=C1)NC(=O)C(=O)N/N=C/C2=C(C=CC(=C2)Br)O)Cl
InChI
InChI=1S/C15H11BrClN3O3/c16-10-5-6-13(21)9(7-10)8-18-20-15(23)14(22)19-12-4-2-1-3-11(12)17/h1-8,21H,(H,19,22)(H,20,23)/b18-8+
InChIKey
LXXSKDUQVSJWLT-QGMBQPNBSA-N
Compound name
N'-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]-N-(2-chlorophenyl)oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

394.96722 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 395.97450 177.5
[M+Na]+ 417.95644 187.2
[M-H]- 393.95994 186.4
[M+NH4]+ 413.00104 192.3
[M+K]+ 433.93038 173.4
[M+H-H2O]+ 377.96448 174.9
[M+HCOO]- 439.96542 196.4
[M+CH3COO]- 453.98107 218.4
[M+Na-2H]- 415.94189 181.9
[M]+ 394.96667 197.0
[M]- 394.96777 197.0
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.