CID 9662144

N'-(5-bromo-2-methoxybenzylidene)-2-(2,3-dichlorophenoxy)acetohydrazide

Structural Information

Molecular Formula
C16H13BrCl2N2O3
SMILES
COC1=C(C=C(C=C1)Br)/C=N/NC(=O)COC2=C(C(=CC=C2)Cl)Cl
InChI
InChI=1S/C16H13BrCl2N2O3/c1-23-13-6-5-11(17)7-10(13)8-20-21-15(22)9-24-14-4-2-3-12(18)16(14)19/h2-8H,9H2,1H3,(H,21,22)/b20-8+
InChIKey
NGIUIDMCFGDGHJ-DNTJNYDQSA-N
Compound name
N-[(E)-(5-bromo-2-methoxyphenyl)methylideneamino]-2-(2,3-dichlorophenoxy)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

429.94867 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 430.95595 183.2
[M+Na]+ 452.93789 195.3
[M-H]- 428.94139 193.0
[M+NH4]+ 447.98249 198.7
[M+K]+ 468.91183 181.2
[M+H-H2O]+ 412.94593 181.7
[M+HCOO]- 474.94687 198.2
[M+CH3COO]- 488.96252 224.3
[M+Na-2H]- 450.92334 187.2
[M]+ 429.94812 208.3
[M]- 429.94922 208.3
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.