CID 78652

2',4'-di(benzyloxy)-2-methoxyacetophenone

Structural Information

Molecular Formula
C23H22O4
SMILES
COCC(=O)C1=C(C=C(C=C1)OCC2=CC=CC=C2)OCC3=CC=CC=C3
InChI
InChI=1S/C23H22O4/c1-25-17-22(24)21-13-12-20(26-15-18-8-4-2-5-9-18)14-23(21)27-16-19-10-6-3-7-11-19/h2-14H,15-17H2,1H3
InChIKey
CXEWRLLTJYRWCL-UHFFFAOYSA-N
Compound name
1-[2,4-bis(phenylmethoxy)phenyl]-2-methoxyethanone
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

362.1518 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 363.15908 188.1
[M+Na]+ 385.14102 203.6
[M+NH4]+ 380.18562 195.7
[M+K]+ 401.11496 194.4
[M-H]- 361.14452 194.5
[M+Na-2H]- 383.12647 198.8
[M]+ 362.15125 192.3
[M]- 362.15235 192.3
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.