CID 135842146

765278-26-0

Structural Information

Molecular Formula
C22H19BrN2O3
SMILES
CC1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)N/N=C/C3=C(C=CC(=C3)Br)O
InChI
InChI=1S/C22H19BrN2O3/c1-15-2-4-16(5-3-15)14-28-20-9-6-17(7-10-20)22(27)25-24-13-18-12-19(23)8-11-21(18)26/h2-13,26H,14H2,1H3,(H,25,27)/b24-13+
InChIKey
XHKIUFRMYCJXFG-ZMOGYAJESA-N
Compound name
N-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]-4-[(4-methylphenyl)methoxy]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

438.05792 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 439.06520 195.8
[M+Na]+ 461.04714 203.9
[M-H]- 437.05064 207.2
[M+NH4]+ 456.09174 207.9
[M+K]+ 477.02108 191.2
[M+H-H2O]+ 421.05518 191.3
[M+HCOO]- 483.05612 217.5
[M+CH3COO]- 497.07177 228.0
[M+Na-2H]- 459.03259 199.3
[M]+ 438.05737 215.2
[M]- 438.05847 215.2
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.