| SpectraBase Spectrum ID |
Cf16avk4C10 |
| Name |
(2S,4R)-7-Methoxy-5-(3-hydroxyprop-1-enyl)-3-(hydroxymethyl)-2-(3-methoxy-4-hydroxyphenyl)dihydrobenzofuran |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
288.208930140 u |
| Formula |
C19H28O2 |
| InChI |
InChI=1S/C19H28O2/c1-13-12-20-19(6,21-13)14-7-8-15-16(11-14)18(4,5)10-9-17(15,2)3/h7-8,11,13H,9-10,12H2,1-6H3/t13-,19+/m1/s1 |
| InChIKey |
JEPWTUCYPWOCQV-YJYMSZOUSA-N |
| SMILES |
[C@@]1(O[C@](C)(CO1)[H])(C1=CC=2C(CCC(C2C=C1)(C)C)(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.940227 |
