CID 9669070

1-(2-(((1,1'-bi-ph)-4-yloxy)ac)carbohydrazonoyl)2-naphthyl 3,4-dimethoxybenzoate

Structural Information

Molecular Formula
C34H28N2O6
SMILES
COC1=C(C=C(C=C1)C(=O)OC2=C(C3=CC=CC=C3C=C2)/C=N/NC(=O)COC4=CC=C(C=C4)C5=CC=CC=C5)OC
InChI
InChI=1S/C34H28N2O6/c1-39-31-19-15-26(20-32(31)40-2)34(38)42-30-18-14-25-10-6-7-11-28(25)29(30)21-35-36-33(37)22-41-27-16-12-24(13-17-27)23-8-4-3-5-9-23/h3-21H,22H2,1-2H3,(H,36,37)/b35-21+
InChIKey
KINVETURABWPLU-XICOUIIWSA-N
Compound name
[1-[(E)-[[2-(4-phenylphenoxy)acetyl]hydrazinylidene]methyl]naphthalen-2-yl] 3,4-dimethoxybenzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

560.19476 Da
Monoisotopic Mass

7.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 561.20204 239.1
[M+Na]+ 583.18398 254.6
[M+NH4]+ 578.22858 244.5
[M+K]+ 599.15792 244.7
[M-H]- 559.18748 248.5
[M+Na-2H]- 581.16943 249.8
[M]+ 560.19421 244.0
[M]- 560.19531 244.0
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.