CID 6873710

N'-(4-(benzyloxy)benzylidene)-2-(5-isopropyl-2-methylphenoxy)acetohydrazide

Structural Information

Molecular Formula
C26H28N2O3
SMILES
CC1=C(C=C(C=C1)C(C)C)OCC(=O)N/N=C/C2=CC=C(C=C2)OCC3=CC=CC=C3
InChI
InChI=1S/C26H28N2O3/c1-19(2)23-12-9-20(3)25(15-23)31-18-26(29)28-27-16-21-10-13-24(14-11-21)30-17-22-7-5-4-6-8-22/h4-16,19H,17-18H2,1-3H3,(H,28,29)/b27-16+
InChIKey
GEMKDTRMNNGSMC-JVWAILMASA-N
Compound name
2-(2-methyl-5-propan-2-ylphenoxy)-N-[(E)-(4-phenylmethoxyphenyl)methylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

416.21 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 417.21728 205.5
[M+Na]+ 439.19922 218.9
[M+NH4]+ 434.24382 212.1
[M+K]+ 455.17316 209.9
[M-H]- 415.20272 212.8
[M+Na-2H]- 437.18467 215.1
[M]+ 416.20945 209.5
[M]- 416.21055 209.5
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.