| SpectraBase Compound ID | 4ulcaZukaGC |
|---|---|
| InChI | InChI=1S/C11H14/c1-3-10(2)9-11-7-5-4-6-8-11/h4-8H,2-3,9H2,1H3 |
| InChIKey | IRHYGDKERVGHIR-UHFFFAOYSA-N |
| Mol Weight | 146.23 g/mol |
| Molecular Formula | C11H14 |
| Exact Mass | 146.10955 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | H5sZDD8uvVc |
|---|---|
| Name | 2-Benzyl-1-butene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 146.109550451 u |
| Formula | C11H14 |
| InChI | InChI=1S/C11H14/c1-3-10(2)9-11-7-5-4-6-8-11/h4-8H,2-3,9H2,1H3 |
| InChIKey | IRHYGDKERVGHIR-UHFFFAOYSA-N |
| Molecular Weight | 146.233 g/mol |
| SMILES | C=1C(CC(=C)CC)=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.93311 |