| SpectraBase Spectrum ID |
LhxsF1eb9JQ |
| Name |
(1R,2R)-1-[3,5-Dimethoxy-4-(methoxymethoxy)phenyl]propane-1,2,3-triol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
288.120902977 u |
| Formula |
C13H20O7 |
| InChI |
InChI=1S/C13H20O7/c1-17-7-20-13-10(18-2)4-8(5-11(13)19-3)12(16)9(15)6-14/h4-5,9,12,14-16H,6-7H2,1-3H3/t9-,12-/m1/s1 |
| InChIKey |
LGIDSFYPUROGSL-BXKDBHETSA-N |
| SMILES |
C=1(C=C(OC)C(=C(C1)OC)OCOC)[C@]([C@](O)(CO)[H])(O)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.911372 |
![(1R,2R)-1-[3,5-dimethoxy-4-(methoxymethoxy)phenyl]propane-1,2,3-triol](/api/spectrum/LhxsF1eb9JQ/structure.png?h=300&w=458 "(1R,2R)-1-[3,5-dimethoxy-4-(methoxymethoxy)phenyl]propane-1,2,3-triol")
