| SpectraBase Spectrum ID |
JKCmiDsLHO9 |
| Name |
4,7-Dimethoxy-6-benzyloxy-5-[(2-carboxy-3,3,dimethylpent-4-en-1-yl)methyl]dihydrobenzofuran |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
426.204238680 u |
| Formula |
C25H30O6 |
| InChI |
InChI=1S/C25H30O6/c1-6-25(2,3)19(24(26)27)14-18-20(28-4)17-12-13-30-21(17)23(29-5)22(18)31-15-16-10-8-7-9-11-16/h6-11,19H,1,12-15H2,2-5H3,(H,26,27) |
| InChIKey |
WGGMZAVZAPUTEC-UHFFFAOYSA-N |
| Molecular Weight |
426.509 g/mol |
| SMILES |
C1(=C(C(OC)=C2C(=C1OC)CCO2)OCC1=CC=CC=C1)CC(C(=O)O)C(C=C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.926212 |
![4,7-Dimethoxy-6-benzyloxy-5-[(2-carboxy-3,3,dimethylpent-4-en-1-yl)methyl]dihydrobenzofuran](/api/spectrum/JKCmiDsLHO9/structure.png?h=300&w=458 "4,7-Dimethoxy-6-benzyloxy-5-[(2-carboxy-3,3,dimethylpent-4-en-1-yl)methyl]dihydrobenzofuran")
