| SpectraBase Compound ID | JwQ3tzJTEeF |
|---|---|
| InChI | InChI=1S/C11H12O/c1-3-4-6-10-7-5-8-11(9-10)12-2/h3-9H,1H2,2H3/b6-4- |
| InChIKey | OSXNBNDBHWYRFY-XQRVVYSFSA-N |
| Mol Weight | 160.22 g/mol |
| Molecular Formula | C11H12O |
| Exact Mass | 160.088815 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Im5gFiqxQgn |
|---|---|
| Name | 1-(3-Methoxyphenyl)buta-1,3-diene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 160.088815005 u |
| Formula | C11H12O |
| InChI | InChI=1S/C11H12O/c1-3-4-6-10-7-5-8-11(9-10)12-2/h3-9H,1H2,2H3/b6-4- |
| InChIKey | OSXNBNDBHWYRFY-XQRVVYSFSA-N |
| Molecular Weight | 160.216 g/mol |
| SMILES | C(\C=C/C=1C=C(OC)C=CC1)=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.851071 |