CID 3637686

N-(4-benzyloxybenzylidene)-4-ethylaniline

Structural Information

Molecular Formula
C22H21NO
SMILES
CCC1=CC=C(C=C1)N=CC2=CC=C(C=C2)OCC3=CC=CC=C3
InChI
InChI=1S/C22H21NO/c1-2-18-8-12-21(13-9-18)23-16-19-10-14-22(15-11-19)24-17-20-6-4-3-5-7-20/h3-16H,2,17H2,1H3
InChIKey
UVKHFXOYFMCKAJ-UHFFFAOYSA-N
Compound name
N-(4-ethylphenyl)-1-(4-phenylmethoxyphenyl)methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

315.16232 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 316.16960 176.9
[M+Na]+ 338.15154 183.0
[M-H]- 314.15504 187.3
[M+NH4]+ 333.19614 191.1
[M+K]+ 354.12548 177.3
[M+H-H2O]+ 298.15958 166.7
[M+HCOO]- 360.16052 202.6
[M+CH3COO]- 374.17617 212.1
[M+Na-2H]- 336.13699 182.3
[M]+ 315.16177 178.4
[M]- 315.16287 178.4
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.