CID 3023675

94134-42-6

Structural Information

Molecular Formula
C24H26O3
SMILES
COC1=CC=C(C=C1)C(OCCC2=CC=CC=C2)OCCC3=CC=CC=C3
InChI
InChI=1S/C24H26O3/c1-25-23-14-12-22(13-15-23)24(26-18-16-20-8-4-2-5-9-20)27-19-17-21-10-6-3-7-11-21/h2-15,24H,16-19H2,1H3
InChIKey
MCHNHTONQUYDHQ-UHFFFAOYSA-N
Compound name
1-[bis(2-phenylethoxy)methyl]-4-methoxybenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

362.1882 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 363.195476 190.3
[M+Na]+ 385.177418 194.0
[M-H]- 361.180924 198.6
[M+NH4]+ 380.222023 201.6
[M+K]+ 401.151358 189.5
[M+H-H2O]+ 345.185460 179.6
[M+HCOO]- 407.186401 211.9
[M+CH3COO]- 421.202051 215.7
[M+Na-2H]- 383.162866 193.2
[M]+ 362.18765142 193.7
[M]- 362.18874858 193.7
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.