CID 51060315

N'-(2-((4-bromobenzyl)oxy)benzylidene)-3,4-dimethoxybenzohydrazide

Structural Information

Molecular Formula
C23H21BrN2O4
SMILES
COC1=C(C=C(C=C1)C(=O)N/N=C/C2=CC=CC=C2OCC3=CC=C(C=C3)Br)OC
InChI
InChI=1S/C23H21BrN2O4/c1-28-21-12-9-17(13-22(21)29-2)23(27)26-25-14-18-5-3-4-6-20(18)30-15-16-7-10-19(24)11-8-16/h3-14H,15H2,1-2H3,(H,26,27)/b25-14+
InChIKey
DZUSXYVUOUGNQZ-AFUMVMLFSA-N
Compound name
N-[(E)-[2-[(4-bromophenyl)methoxy]phenyl]methylideneamino]-3,4-dimethoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

468.06848 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 469.07576 201.1
[M+Na]+ 491.05770 205.4
[M+NH4]+ 486.10230 204.0
[M+K]+ 507.03164 203.2
[M-H]- 467.06120 205.8
[M+Na-2H]- 489.04315 206.9
[M]+ 468.06793 201.9
[M]- 468.06903 201.9
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.