| SpectraBase Spectrum ID |
1a2bv5SQTEH |
| Name |
5-Allyl-2-(benzyloxy)-3-methoxybenzaldehyde |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
282.125594437 u |
| Formula |
C18H18O3 |
| InChI |
InChI=1S/C18H18O3/c1-3-7-15-10-16(12-19)18(17(11-15)20-2)21-13-14-8-5-4-6-9-14/h3-6,8-12H,1,7,13H2,2H3 |
| InChIKey |
GABDRLJVYLEKQW-UHFFFAOYSA-N |
| SMILES |
C=1(C(=C(OC)C=C(C1)CC=C)OCC1=CC=CC=C1)C=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.936326 |