CID 135821628

N'-(5-bromo-2-hydroxybenzylidene)-2-((4-chlorobenzyl)oxy)benzohydrazide

Structural Information

Molecular Formula
C21H16BrClN2O3
SMILES
C1=CC=C(C(=C1)C(=O)N/N=C/C2=C(C=CC(=C2)Br)O)OCC3=CC=C(C=C3)Cl
InChI
InChI=1S/C21H16BrClN2O3/c22-16-7-10-19(26)15(11-16)12-24-25-21(27)18-3-1-2-4-20(18)28-13-14-5-8-17(23)9-6-14/h1-12,26H,13H2,(H,25,27)/b24-12+
InChIKey
QWUBVYWYONLBHQ-WYMPLXKRSA-N
Compound name
N-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]-2-[(4-chlorophenyl)methoxy]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

458.00327 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 459.01055 196.9
[M+Na]+ 480.99249 206.5
[M-H]- 456.99599 208.3
[M+NH4]+ 476.03709 209.3
[M+K]+ 496.96643 192.4
[M+H-H2O]+ 441.00053 193.4
[M+HCOO]- 503.00147 214.7
[M+CH3COO]- 517.01712 228.5
[M+Na-2H]- 478.97794 200.6
[M]+ 458.00272 218.4
[M]- 458.00382 218.4
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.