SpectraBase Spectrum ID |
IlGzh4aHniT |
Name |
Dinoresinol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
358.141638422 u |
Formula |
C20H22O6 |
InChI |
InChI=1S/C20H22O6/c1-23-17-7-11(3-5-15(17)21)19-13-9-26-20(14(13)10-25-19)12-4-6-16(22)18(8-12)24-2/h3-8,13-14,19-22H,9-10H2,1-2H3 |
InChIKey |
HGXBRUKMWQGOIE-UHFFFAOYSA-N |
Molecular Weight |
358.390 g/mol |
SMILES |
OC=1C(=CC(C2C3COC(C=4C=C(C(=CC4)O)OC)C3CO2)=CC1)OC |
Spectrum/Structure Validation Score (Raman) |
0.979462 |