SpectraBase Spectrum ID |
2Rq0HRWSofV |
Name |
1,2-Dibenzyl-4-[3-(2-benzyloxy-3-methoxyphenyl)-1-oxoprop-2-en-1-yl]benzene |
Comments |
Note: The molecular formula of the structure shown is C37H32O3 - which differs from the formula reported for the mass spectrum (C37H32O5) |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C37H32O5 |
InChI |
InChI=1S/C37H32O3/c1-39-36-19-11-18-31(37(36)40-27-30-16-9-4-10-17-30)22-23-35(38)33-21-20-32(24-28-12-5-2-6-13-28)34(26-33)25-29-14-7-3-8-15-29/h2-23,26H,24-25,27H2,1H3 |
InChIKey |
MFLGXYYPYQDHQG-UHFFFAOYSA-N |
Molecular Weight |
524.660 g/mol |
SMILES |
C(c1ccccc1)c1c(cc(cc1)C(C=Cc1c(c(ccc1)OC)OCc1ccccc1)=O)Cc1ccccc1 |
SPLASH |
splash10-0006-9000000000-cb49c1af02911a84db41 |
Source of Spectrum |
O1-31-1636-22 |
Wiley ID |
818933 |