CID 45054527

4-((4-methylbenzyl)oxy)-n'-(1-naphthylmethylene)benzohydrazide

Structural Information

Molecular Formula

C₂₆H₂₂N₂O₂

SMILES

CC1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)N/N=C/C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C26H22N2O2/c1-19-9-11-20(12-10-19)18-30-24-15-13-22(14-16-24)26(29)28-27-17-23-7-4-6-21-5-2-3-8-25(21)23/h2-17H,18H2,1H3,(H,28,29)/b27-17+

InChIKey

BWERJKYTMZTXTD-WPWMEQJKSA-N

Compound name

4-[(4-methylphenyl)methoxy]-N-[(E)-naphthalen-1-ylmethylideneamino]benzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 394.16812 Da
Monoisotopic Mass: 5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	395.175396	196.5
[M+Na]+	417.157338	201.8
[M-H]-	393.160844	207.4
[M+NH4]+	412.201943	207.7
[M+K]+	433.131278	195.6
[M+H-H2O]+	377.165380	184.9
[M+HCOO]-	439.166321	220.6
[M+CH3COO]-	453.181971	205.9
[M+Na-2H]-	415.142786	201.5
[M]+	394.16757142	197.5
[M]-	394.16866858	197.5

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.