CID 9688158

N'-(3-bromobenzylidene)-2-(2,3-dichlorophenoxy)acetohydrazide

Structural Information

Molecular Formula
C15H11BrCl2N2O2
SMILES
C1=CC(=CC(=C1)Br)/C=N/NC(=O)COC2=C(C(=CC=C2)Cl)Cl
InChI
InChI=1S/C15H11BrCl2N2O2/c16-11-4-1-3-10(7-11)8-19-20-14(21)9-22-13-6-2-5-12(17)15(13)18/h1-8H,9H2,(H,20,21)/b19-8+
InChIKey
NJBWLGACHIHEGE-UFWORHAWSA-N
Compound name
N-[(E)-(3-bromophenyl)methylideneamino]-2-(2,3-dichlorophenoxy)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

399.9381 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 400.94538 176.9
[M+Na]+ 422.92732 188.9
[M-H]- 398.93082 186.5
[M+NH4]+ 417.97192 193.4
[M+K]+ 438.90126 174.2
[M+H-H2O]+ 382.93536 175.6
[M+HCOO]- 444.93630 192.1
[M+CH3COO]- 458.95195 218.5
[M+Na-2H]- 420.91277 181.9
[M]+ 399.93755 200.0
[M]- 399.93865 200.0
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.