| SpectraBase Compound ID | nncx20mapS |
|---|---|
| InChI | InChI=1S/C9H12O/c1-3-8-6-7(2)4-5-9(8)10/h4-6,10H,3H2,1-2H3 |
| InChIKey | AVVVXUXMKWPKAJ-UHFFFAOYSA-N |
| Mol Weight | 136.19 g/mol |
| Molecular Formula | C9H12O |
| Exact Mass | 136.088815 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | HHnWEdakhM8 |
|---|---|
| Name | 2-Ethyl-4-methyl-phenol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 136.088815005 u |
| Formula | C9H12O |
| InChI | InChI=1S/C9H12O/c1-3-8-6-7(2)4-5-9(8)10/h4-6,10H,3H2,1-2H3 |
| InChIKey | AVVVXUXMKWPKAJ-UHFFFAOYSA-N |
| Molecular Weight | 136.194 g/mol |
| SMILES | C1(O)=C(CC)C=C(C)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.93499 |