| SpectraBase Spectrum ID |
DTZNq9QhaTX |
| Name |
1-Methoxy-2-(2-methyl-4-pentenyl)benzene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
190.135765199 u |
| Formula |
C13H18O |
| InChI |
InChI=1S/C13H18O/c1-4-7-11(2)10-12-8-5-6-9-13(12)14-3/h4-6,8-9,11H,1,7,10H2,2-3H3 |
| InChIKey |
QRWXMOWEIAPVMQ-UHFFFAOYSA-N |
| Molecular Weight |
190.286 g/mol |
| SMILES |
C=1(CC(CC=C)C)C(OC)=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.866975 |
