CID 9669645

4-(2-((4-propylphenoxy)acetyl)carbohydrazonoyl)phenyl benzoate

Structural Information

Molecular Formula
C25H24N2O4
SMILES
CCCC1=CC=C(C=C1)OCC(=O)N/N=C/C2=CC=C(C=C2)OC(=O)C3=CC=CC=C3
InChI
InChI=1S/C25H24N2O4/c1-2-6-19-9-13-22(14-10-19)30-18-24(28)27-26-17-20-11-15-23(16-12-20)31-25(29)21-7-4-3-5-8-21/h3-5,7-17H,2,6,18H2,1H3,(H,27,28)/b26-17+
InChIKey
VZDKXBIXWPNZKF-YZSQISJMSA-N
Compound name
[4-[(E)-[[2-(4-propylphenoxy)acetyl]hydrazinylidene]methyl]phenyl] benzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

416.1736 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 417.18088 203.0
[M+Na]+ 439.16282 215.7
[M+NH4]+ 434.20742 208.8
[M+K]+ 455.13676 207.2
[M-H]- 415.16632 209.4
[M+Na-2H]- 437.14827 212.5
[M]+ 416.17305 206.4
[M]- 416.17415 206.4
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.