| SpectraBase Spectrum ID |
BOcRJxFJnMA |
| Name |
(1S,2S)-1,3-o-Benzylidene-1-(4-benzyloxy-3-methoxyphenyl)-1,2,3-propantriol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
392.162373868 u |
| Formula |
C24H24O5 |
| InChI |
InChI=1S/C24H24O5/c1-26-22-14-19(12-13-21(22)27-15-17-8-4-2-5-9-17)23-20(25)16-28-24(29-23)18-10-6-3-7-11-18/h2-14,20,23-25H,15-16H2,1H3/t20-,23-,24+/m0/s1 |
| InChIKey |
YNULIXXNXHYTQX-NKKJXINNSA-N |
| Molecular Weight |
392.451 g/mol |
| SMILES |
[C@@]1(O[C@@](OC[C@@]1(O)[H])(C=1C=CC=CC1)[H])(C=1C=C(OC)C(=CC1)OCC=1C=CC=CC1)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.910882 |
