CID 9688707

N'-(4-((4-chlorobenzyl)oxy)-3-methoxybenzylidene)-1-naphthohydrazide

Structural Information

Molecular Formula
C26H21ClN2O3
SMILES
COC1=C(C=CC(=C1)/C=N/NC(=O)C2=CC=CC3=CC=CC=C32)OCC4=CC=C(C=C4)Cl
InChI
InChI=1S/C26H21ClN2O3/c1-31-25-15-19(11-14-24(25)32-17-18-9-12-21(27)13-10-18)16-28-29-26(30)23-8-4-6-20-5-2-3-7-22(20)23/h2-16H,17H2,1H3,(H,29,30)/b28-16+
InChIKey
GDAFWANMXYPTQD-LQKURTRISA-N
Compound name
N-[(E)-[4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]methylideneamino]naphthalene-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

444.12408 Da
Monoisotopic Mass

6.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 445.13136 207.4
[M+Na]+ 467.11330 214.3
[M-H]- 443.11680 218.6
[M+NH4]+ 462.15790 217.8
[M+K]+ 483.08724 207.6
[M+H-H2O]+ 427.12134 196.4
[M+HCOO]- 489.12228 227.2
[M+CH3COO]- 503.13793 216.7
[M+Na-2H]- 465.09875 211.3
[M]+ 444.12353 213.0
[M]- 444.12463 213.0
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.