| SpectraBase Compound ID | AMe1kLnvayV |
|---|---|
| InChI | InChI=1S/C11H16O/c1-3-8-12-11-7-5-6-10(4-2)9-11/h5-7,9H,3-4,8H2,1-2H3 |
| InChIKey | KCWFHRHQYCLXBU-UHFFFAOYSA-N |
| Mol Weight | 164.25 g/mol |
| Molecular Formula | C11H16O |
| Exact Mass | 164.120115 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Lr5aQlZrOas |
|---|---|
| Name | 3-Ethylphenol, N-propyl ether |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 164.120115134 u |
| Formula | C11H16O |
| InChI | InChI=1S/C11H16O/c1-3-8-12-11-7-5-6-10(4-2)9-11/h5-7,9H,3-4,8H2,1-2H3 |
| InChIKey | KCWFHRHQYCLXBU-UHFFFAOYSA-N |
| Molecular Weight | 164.248 g/mol |
| SMILES | C1=C(C=CC=C1OCCC)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.97818 |