| SpectraBase Compound ID | 4FPi0Ts8PsN |
|---|---|
| InChI | InChI=1S/C12H16O/c1-9-6-7-12(13)11(8-9)10-4-2-3-5-10/h6-8,10,13H,2-5H2,1H3 |
| InChIKey | KDHONNUUDHJCID-UHFFFAOYSA-N |
| Mol Weight | 176.26 g/mol |
| Molecular Formula | C12H16O |
| Exact Mass | 176.120115 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3FfaTjHIwk5 |
|---|---|
| Name | 2-Cyclopentyl-4-methyl-phenol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 176.120115134 u |
| Formula | C12H16O |
| InChI | InChI=1S/C12H16O/c1-9-6-7-12(13)11(8-9)10-4-2-3-5-10/h6-8,10,13H,2-5H2,1H3 |
| InChIKey | KDHONNUUDHJCID-UHFFFAOYSA-N |
| Molecular Weight | 176.259 g/mol |
| SMILES | C=1(C(=CC=C(C1)C)O)C1CCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.906481 |