| SpectraBase Spectrum ID |
GnUbhoUzcnG |
| Name |
Beilschmin_B;(2-S,3-S,4-S,5-R)-3',4',5',3'',4'',5''-hexamethoxy-2,5-epoxylignan |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
432.214803363 u |
| Formula |
C24H32O7 |
| InChI |
InChI=1S/C24H32O7/c1-13-14(2)22(16-11-19(27-5)24(30-8)20(12-16)28-6)31-21(13)15-9-17(25-3)23(29-7)18(10-15)26-4/h9-14,21-22H,1-8H3 |
| InChIKey |
ZPINJJOPURFFNV-UHFFFAOYSA-N |
| Molecular Weight |
432.513 g/mol |
| SMILES |
C1(OC)=CC(=CC(=C1OC)OC)C1C(C)C(C)C(O1)C1=CC(OC)=C(OC)C(OC)=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.849533 |
