CID 45054905

N'-(4-((4-chlorobenzyl)oxy)-3-ethoxybenzylidene)decanohydrazide

Structural Information

Molecular Formula
C26H35ClN2O3
SMILES
CCCCCCCCCC(=O)N/N=C/C1=CC(=C(C=C1)OCC2=CC=C(C=C2)Cl)OCC
InChI
InChI=1S/C26H35ClN2O3/c1-3-5-6-7-8-9-10-11-26(30)29-28-19-22-14-17-24(25(18-22)31-4-2)32-20-21-12-15-23(27)16-13-21/h12-19H,3-11,20H2,1-2H3,(H,29,30)/b28-19+
InChIKey
YQUGBIBPCZLFHU-TURZUDJPSA-N
Compound name
N-[(E)-[4-[(4-chlorophenyl)methoxy]-3-ethoxyphenyl]methylideneamino]decanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

458.2336 Da
Monoisotopic Mass

7.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 459.24088 216.9
[M+Na]+ 481.22282 220.5
[M-H]- 457.22632 223.1
[M+NH4]+ 476.26742 226.5
[M+K]+ 497.19676 214.1
[M+H-H2O]+ 441.23086 206.9
[M+HCOO]- 503.23180 236.1
[M+CH3COO]- 517.24745 241.1
[M+Na-2H]- 479.20827 215.9
[M]+ 458.23305 226.1
[M]- 458.23415 226.1
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.