| SpectraBase Spectrum ID |
2X7drg4hf9N |
| Name |
(1S,2R)-(-)-1-[4-(3-methyl-2-butenyl)-oxyphenyl]-propane-1,2-diol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
236.141244501 u |
| Formula |
C14H20O3 |
| InChI |
InChI=1S/C14H20O3/c1-10(2)8-9-17-13-6-4-12(5-7-13)14(16)11(3)15/h4-8,11,14-16H,9H2,1-3H3 |
| InChIKey |
BOXJUNYZZTUBHE-UHFFFAOYSA-N |
| Molecular Weight |
236.311 g/mol |
| SMILES |
C(O)(C=1C=CC(=CC1)OCC=C(C)C)C(O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.975148 |
![(1S,2R)-(-)-1-[4-(3-methyl-2-butenyl)-oxyphenyl]-propane-1,2-diol](/api/spectrum/2X7drg4hf9N/structure.png?h=300&w=458 "(1S,2R)-(-)-1-[4-(3-methyl-2-butenyl)-oxyphenyl]-propane-1,2-diol")
