CID 9623882

2-ethoxy-4-(2-(1-naphthoyl)carbohydrazonoyl)phenyl benzoate

Structural Information

Molecular Formula
C27H22N2O4
SMILES
CCOC1=C(C=CC(=C1)/C=N/NC(=O)C2=CC=CC3=CC=CC=C32)OC(=O)C4=CC=CC=C4
InChI
InChI=1S/C27H22N2O4/c1-2-32-25-17-19(15-16-24(25)33-27(31)21-10-4-3-5-11-21)18-28-29-26(30)23-14-8-12-20-9-6-7-13-22(20)23/h3-18H,2H2,1H3,(H,29,30)/b28-18+
InChIKey
SDEYELWKFKLQOS-MTDXEUNCSA-N
Compound name
[2-ethoxy-4-[(E)-(naphthalene-1-carbonylhydrazinylidene)methyl]phenyl] benzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

438.15796 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 439.16524 207.2
[M+Na]+ 461.14718 221.9
[M+NH4]+ 456.19178 214.0
[M+K]+ 477.12112 212.5
[M-H]- 437.15068 214.9
[M+Na-2H]- 459.13263 217.4
[M]+ 438.15741 211.5
[M]- 438.15851 211.5
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.