| SpectraBase Spectrum ID |
LwPRtsvYQZI |
| Name |
4-[3'-Methoxy-4',.alpha.-diacetoxybenzyl]-2-acetoxy-3-[3''-methoxy-4''-acetoxybenzyl]-tetrahydrofuran |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
544.194461839 u |
| Formula |
C28H32O11 |
| InChI |
InChI=1S/C28H32O11/c1-15(29)36-23-9-7-19(12-25(23)33-5)11-21-22(14-35-28(21)39-18(4)32)27(38-17(3)31)20-8-10-24(37-16(2)30)26(13-20)34-6/h7-10,12-13,21-22,27-28H,11,14H2,1-6H3 |
| InChIKey |
IGMJFRNDINWZPK-UHFFFAOYSA-N |
| Molecular Weight |
544.553 g/mol |
| SMILES |
C1(C(C(OC(=O)C)OC1)CC=1C=C(OC)C(=CC1)OC(=O)C)C(C1=CC(OC)=C(C=C1)OC(=O)C)OC(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.838948 |
