| SpectraBase Compound ID | I0Mz99kpsGl |
|---|---|
| InChI | InChI=1S/C11H16O/c1-9-4-6-10(7-5-9)8-11(2,3)12/h4-7,12H,8H2,1-3H3 |
| InChIKey | LABNAHQUILHURR-UHFFFAOYSA-N |
| Mol Weight | 164.25 g/mol |
| Molecular Formula | C11H16O |
| Exact Mass | 164.120115 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | goabPEP5ac |
|---|---|
| Name | p,alpha,alpha-Trimethylphenethyl alcohol |
| 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/c1-9-4-6-10(7-5-9)8-11(2,3)12/h4-7,12H,8H2,1-3H3 |
| InChIKey | LABNAHQUILHURR-UHFFFAOYSA-N |
| Molecular Weight | 164.248 g/mol |
| SMILES | OC(CC1=CC=C(C=C1)C)(C)C |
| Spectrum/Structure Validation Score (Raman) | 0.976621 |