| SpectraBase Spectrum ID |
F3eKKH0hmYL |
| Name |
1,2-bis(2,4,5-Trimethoxyphenyl)-1,2-ethanediol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
394.162767789 u |
| Formula |
C20H26O8 |
| InChI |
InChI=1S/C20H26O8/c1-23-13-9-17(27-5)15(25-3)7-11(13)19(21)20(22)12-8-16(26-4)18(28-6)10-14(12)24-2/h7-10,19-22H,1-6H3 |
| InChIKey |
XBYSWDAETJFSDP-UHFFFAOYSA-N |
| Molecular Weight |
394.420 g/mol |
| SMILES |
OC(C(C1=C(C=C(C(=C1)OC)OC)OC)O)C=1C=C(C(=CC1OC)OC)OC |
| Spectrum/Structure Validation Score (Raman) |
0.989701 |
