| SpectraBase Spectrum ID |
41AISHrDvXS |
| Name |
3-[5'-[2'-[4''-{hydroxymethyl)-2''-methoxyphenyl]-5'-methoxyphenetyl}-2'-methoxyphenyl]-4-methoxybenzaldehyde |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
512.219888744 u |
| Formula |
C32H32O6 |
| InChI |
InChI=1S/C32H32O6/c1-35-25-10-12-26(27-11-6-23(20-34)17-32(27)38-4)24(18-25)9-5-21-7-13-30(36-2)28(15-21)29-16-22(19-33)8-14-31(29)37-3/h6-8,10-19,34H,5,9,20H2,1-4H3 |
| InChIKey |
KQHBSUROTISCIP-UHFFFAOYSA-N |
| Molecular Weight |
512.602 g/mol |
| SMILES |
C1(C=2C(=CC=C(C2)CCC=2C(C3=C(C=C(C=C3)CO)OC)=CC=C(C2)OC)OC)=C(C=CC(=C1)C=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.845518 |
![3-[5'-[2'-[4''-{Hydroxymethyl)-2''-methoxyphenyl]-5'-methoxyphenetyl}-2'-methoxyphenyl]-4-methoxybenzaldehyde](/api/spectrum/41AISHrDvXS/structure.png?h=300&w=458 "3-[5'-[2'-[4''-{Hydroxymethyl)-2''-methoxyphenyl]-5'-methoxyphenetyl}-2'-methoxyphenyl]-4-methoxybenzaldehyde")
