CID 9632335

1-(2-(2,4-dihydroxybenzoyl)carbohydrazonoyl)-2-naphthyl 4-methoxybenzoate

Structural Information

Molecular Formula
C26H20N2O6
SMILES
COC1=CC=C(C=C1)C(=O)OC2=C(C3=CC=CC=C3C=C2)/C=N/NC(=O)C4=C(C=C(C=C4)O)O
InChI
InChI=1S/C26H20N2O6/c1-33-19-10-6-17(7-11-19)26(32)34-24-13-8-16-4-2-3-5-20(16)22(24)15-27-28-25(31)21-12-9-18(29)14-23(21)30/h2-15,29-30H,1H3,(H,28,31)/b27-15+
InChIKey
GSEFQIOVSIFFHE-JFLMPSFJSA-N
Compound name
[1-[(E)-[(2,4-dihydroxybenzoyl)hydrazinylidene]methyl]naphthalen-2-yl] 4-methoxybenzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

456.13214 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 457.13942 206.7
[M+Na]+ 479.12136 211.7
[M-H]- 455.12486 215.9
[M+NH4]+ 474.16596 213.9
[M+K]+ 495.09530 208.0
[M+H-H2O]+ 439.12940 195.4
[M+HCOO]- 501.13034 227.5
[M+CH3COO]- 515.14599 236.4
[M+Na-2H]- 477.10681 209.2
[M]+ 456.13159 209.3
[M]- 456.13269 209.3
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.