| SpectraBase Spectrum ID |
DZPkjhXnfoO |
| Name |
3-Phenoxybenzyl (E)-2-methylbut-2-enoate |
| 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/c1-3-14(2)18(19)20-13-15-8-7-11-17(12-15)21-16-9-5-4-6-10-16/h3-12H,13H2,1-2H3/b14-3+ |
| InChIKey |
PTDIDLMUDYYUQZ-LZWSPWQCSA-N |
| SMILES |
C(=O)(\C(C)=C\C)OCC1=CC(OC2=CC=CC=C2)=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.900009 |
