| SpectraBase Spectrum ID |
H5duaQqW2rQ |
| Name |
(E)-((5-ethylocta-3,5,6-trienyloxy)methyl)benzene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
242.167065327 u |
| Formula |
C17H22O |
| InChI |
InChI=1S/C17H22O/c1-3-10-16(4-2)11-8-9-14-18-15-17-12-6-5-7-13-17/h3,5-8,11-13H,4,9,14-15H2,1-2H3/b11-8+ |
| InChIKey |
NDJAJYGQOHOUQA-DHZHZOJOSA-N |
| Molecular Weight |
242.362 g/mol |
| SMILES |
C(=C=CC)(\C=C\CCOCC1=CC=CC=C1)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.82225 |