| SpectraBase Spectrum ID |
BPrYrmj6n2J |
| Name |
(1S)-1-[(4R)-2,2-Dimethyl-1.3-dioxolan-4-yl]but-3-en-1-ol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
172.109944372 u |
| Formula |
C9H16O3 |
| InChI |
InChI=1S/C9H16O3/c1-4-5-7(10)8-6-11-9(2,3)12-8/h4,7-8,10H,1,5-6H2,2-3H3/t7-,8+/m0/s1 |
| InChIKey |
JLOSETSSWWTNSQ-JGVFFNPUSA-N |
| Molecular Weight |
172.224 g/mol |
| SMILES |
C1(O[C@](CO1)([C@@](O)(CC=C)[H])[H])(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.969205 |
![(1S)-1-[(4R)-2,2-Dimethyl-1.3-dioxolan-4-yl]but-3-en-1-ol](/api/spectrum/BPrYrmj6n2J/structure.png?h=300&w=458 "(1S)-1-[(4R)-2,2-Dimethyl-1.3-dioxolan-4-yl]but-3-en-1-ol")
