| SpectraBase Compound ID | Ap1D06EqsYT |
|---|---|
| InChI | InChI=1S/C13H16O/c1-11(12-7-3-2-4-8-12)13-9-5-6-10-14-13/h2-4,7-8,13H,1,5-6,9-10H2 |
| InChIKey | HUEOSFJLBXLUGS-UHFFFAOYSA-N |
| Mol Weight | 188.27 g/mol |
| Molecular Formula | C13H16O |
| Exact Mass | 188.120115 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3IME7jO8ZTa |
|---|---|
| Name | 2-(1-Phenylethenyl)oxane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 188.120115134 u |
| Formula | C13H16O |
| InChI | InChI=1S/C13H16O/c1-11(12-7-3-2-4-8-12)13-9-5-6-10-14-13/h2-4,7-8,13H,1,5-6,9-10H2 |
| InChIKey | HUEOSFJLBXLUGS-UHFFFAOYSA-N |
| Molecular Weight | 188.270 g/mol |
| SMILES | C(C1OCCCC1)(C1=CC=CC=C1)=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.93327 |