| SpectraBase Spectrum ID |
A8lDlaZ1FsT |
| Name |
[(2S)(2R,4R.6R)]-1-[4'-(Benzyloxy)-6'-methoxy-3',3'-dimethyltetrahydropyran-2'-yl]propan-2-ol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
308.198759378 u |
| Formula |
C18H28O4 |
| InChI |
InChI=1S/C18H28O4/c1-13(19)10-16-18(2,3)15(11-17(20-4)22-16)21-12-14-8-6-5-7-9-14/h5-9,13,15-17,19H,10-12H2,1-4H3/t13-,15+,16+,17+/m0/s1 |
| InChIKey |
SQGXMBSURHJTOZ-RKTXRCNFSA-N |
| Molecular Weight |
308.418 g/mol |
| SMILES |
C1([C@](O[C@](C[C@]1(OCC=1C=CC=CC1)[H])(OC)[H])(C[C@@](O)(C)[H])[H])(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.894901 |
![[(2S)(2R,4R.6R)]-1-[4'-(Benzyloxy)-6'-methoxy-3',3'-dimethyltetrahydropyran-2'-yl]propan-2-ol](/api/spectrum/A8lDlaZ1FsT/structure.png?h=300&w=458 "[(2S)(2R,4R.6R)]-1-[4'-(Benzyloxy)-6'-methoxy-3',3'-dimethyltetrahydropyran-2'-yl]propan-2-ol")
