| SpectraBase Compound ID | FI12p9WeweA |
|---|---|
| InChI | InChI=1S/C12H16O/c1-9-3-4-10-6-12(2,8-13)7-11(10)5-9/h3-5,13H,6-8H2,1-2H3 |
| InChIKey | UWSPWQQZFOSTHS-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 | K76SjewlwQA |
|---|---|
| Name | (2,5-Dimethyl-1,3-dihydroinden-2-yl)methanol |
| 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/c1-9-3-4-10-6-12(2,8-13)7-11(10)5-9/h3-5,13H,6-8H2,1-2H3 |
| InChIKey | UWSPWQQZFOSTHS-UHFFFAOYSA-N |
| Molecular Weight | 176.259 g/mol |
| SMILES | C1C(CC=2C=C(C=CC12)C)(CO)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.923032 |