| SpectraBase Spectrum ID |
77s6drZh9H2 |
| Name |
(7S,8R,8'R)-3,3',4,4'-Tetramethoxy-7,9'-epoxylignan-9-ol;lariciresinol-dimethylether |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
388.188588616 u |
| Formula |
C22H28O6 |
| InChI |
InChI=1S/C22H28O6/c1-24-18-7-5-14(10-20(18)26-3)9-16-13-28-22(17(16)12-23)15-6-8-19(25-2)21(11-15)27-4/h5-8,10-11,16-17,22-23H,9,12-13H2,1-4H3/t16-,17-,22+/m0/s1 |
| InChIKey |
AYWPHVUFQNWITL-PNLZDCPESA-N |
| Molecular Weight |
388.460 g/mol |
| SMILES |
C1(OC)=C(C=C([C@@]2([C@@](CO)([C@](CO2)(CC2=CC(=C(C=C2)OC)OC)[H])[H])[H])C=C1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.967793 |
