| SpectraBase Spectrum ID |
9t2SBJpa4fN |
| Name |
(E)-5-(1,3-Benzodioxol-5-yl)-2-penten-1-ol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
206.094294308 u |
| Formula |
C12H14O3 |
| InChI |
InChI=1S/C12H14O3/c13-7-3-1-2-4-10-5-6-11-12(8-10)15-9-14-11/h1,3,5-6,8,13H,2,4,7,9H2/b3-1+ |
| InChIKey |
RHXVXDLAZVDCCE-HNQUOIGGSA-N |
| Molecular Weight |
206.241 g/mol |
| SMILES |
C=12C(OCO2)=CC=C(C1)CC\C=C\CO |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.982965 |
