| SpectraBase Spectrum ID |
FEVt7pHitlx |
| Name |
1-[(2Z)-5-Butylhexa-2,5-dien-1-yl]-4-methoxybenzene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
244.182715392 u |
| Formula |
C17H24O |
| InChI |
InChI=1S/C17H24O/c1-4-5-8-15(2)9-6-7-10-16-11-13-17(18-3)14-12-16/h6-7,11-14H,2,4-5,8-10H2,1,3H3/b7-6- |
| InChIKey |
HPHBSDLOEGKYAB-SREVYHEPSA-N |
| Molecular Weight |
244.378 g/mol |
| SMILES |
C=1C=C(C\C=C/CC(CCCC)=C)C=CC1OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.938414 |