| SpectraBase Compound ID | KVc2ak6BbsF |
|---|---|
| InChI | InChI=1S/C11H10O/c1-10(12-2)8-9-11-6-4-3-5-7-11/h3-7H,1H2,2H3 |
| InChIKey | PRXXHFSFLBPJRY-UHFFFAOYSA-N |
| Mol Weight | 158.2 g/mol |
| Molecular Formula | C11H10O |
| Exact Mass | 158.073165 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Hpf8BUeeffU |
|---|---|
| Name | 3-Methoxy-1-phenyl-3-buten-1-yne |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 158.073164941 u |
| Formula | C11H10O |
| InChI | InChI=1S/C11H10O/c1-10(12-2)8-9-11-6-4-3-5-7-11/h3-7H,1H2,2H3 |
| InChIKey | PRXXHFSFLBPJRY-UHFFFAOYSA-N |
| Molecular Weight | 158.200 g/mol |
| SMILES | C1=CC=CC(C#CC(=C)OC)=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.809585 |