| SpectraBase Spectrum ID |
DU6IKo3xQWh |
| Name |
(2R,3R,4R,5S,6S)-2-Benzoxy-4-methoxy-6-methyl-tetrahydropyran-3,5-diol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
268.131073739 u |
| Formula |
C14H20O5 |
| InChI |
InChI=1S/C14H20O5/c1-9-11(15)13(17-2)12(16)14(19-9)18-8-10-6-4-3-5-7-10/h3-7,9,11-16H,8H2,1-2H3/t9-,11-,12+,13+,14+/m0/s1 |
| InChIKey |
CHBUWBIKIQSWPQ-DDNMXHNFSA-N |
| Molecular Weight |
268.309 g/mol |
| SMILES |
[C@@]1([C@@]([C@@](O)([C@@](O[C@]1(OCC=1C=CC=CC1)[H])(C)[H])[H])(OC)[H])(O)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.808841 |
