SpectraBase Spectrum ID |
K8sJ4nG873v |
Name |
2-Allyl-3-ethoxy-4-methoxybenzyl alcohol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
222.125594437 u |
Formula |
C13H18O3 |
InChI |
InChI=1S/C13H18O3/c1-4-6-11-10(9-14)7-8-12(15-3)13(11)16-5-2/h4,7-8,14H,1,5-6,9H2,2-3H3 |
InChIKey |
CGPOKLBKYUMFOR-UHFFFAOYSA-N |
Molecular Weight |
222.284 g/mol |
SMILES |
C(C=1C(=C(C(=CC1)OC)OCC)CC=C)O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.859301 |