CID 3067186

3-phenoxybenzyl 2-(4-ethoxymethoxyphenyl)-2-methylpropyl ether

Structural Information

Molecular Formula
C26H30O4
SMILES
CCOCOC1=CC=C(C=C1)C(C)(C)COCC2=CC(=CC=C2)OC3=CC=CC=C3
InChI
InChI=1S/C26H30O4/c1-4-27-20-29-23-15-13-22(14-16-23)26(2,3)19-28-18-21-9-8-12-25(17-21)30-24-10-6-5-7-11-24/h5-17H,4,18-20H2,1-3H3
InChIKey
FKEGMQOBNPESIH-UHFFFAOYSA-N
Compound name
1-(ethoxymethoxy)-4-[2-methyl-1-[(3-phenoxyphenyl)methoxy]propan-2-yl]benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

406.21442 Da
Monoisotopic Mass

7.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 407.22170 202.7
[M+Na]+ 429.20364 217.6
[M+NH4]+ 424.24824 210.0
[M+K]+ 445.17758 208.2
[M-H]- 405.20714 208.8
[M+Na-2H]- 427.18909 213.1
[M]+ 406.21387 206.9
[M]- 406.21497 206.9
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

patents stripe