CID 9647105

N'-(5-bromo-2-methoxybenzylidene)-2-(2-chlorophenoxy)acetohydrazide

Structural Information

Molecular Formula
C16H14BrClN2O3
SMILES
COC1=C(C=C(C=C1)Br)/C=N/NC(=O)COC2=CC=CC=C2Cl
InChI
InChI=1S/C16H14BrClN2O3/c1-22-14-7-6-12(17)8-11(14)9-19-20-16(21)10-23-15-5-3-2-4-13(15)18/h2-9H,10H2,1H3,(H,20,21)/b19-9+
InChIKey
XRQJPBFGDTYVJJ-DJKKODMXSA-N
Compound name
N-[(E)-(5-bromo-2-methoxyphenyl)methylideneamino]-2-(2-chlorophenoxy)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

395.98764 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 396.99492 178.7
[M+Na]+ 418.97686 189.4
[M-H]- 394.98036 188.8
[M+NH4]+ 414.02146 194.7
[M+K]+ 434.95080 176.4
[M+H-H2O]+ 378.98490 176.3
[M+HCOO]- 440.98584 198.6
[M+CH3COO]- 455.00149 219.5
[M+Na-2H]- 416.96231 183.9
[M]+ 395.98709 202.4
[M]- 395.98819 202.4
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.