| SpectraBase Compound ID | CruWHjSpWKS |
|---|---|
| InChI | InChI=1S/C10H13ClO/c1-10(11,8-12)7-9-5-3-2-4-6-9/h2-6,12H,7-8H2,1H3 |
| InChIKey | HLKKNIMVNJYHLQ-UHFFFAOYSA-N |
| Mol Weight | 184.67 g/mol |
| Molecular Formula | C10H13ClO |
| Exact Mass | 184.065493 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 2VwTlSOdO0A |
|---|---|
| Name | 2-Chloro-2-methyl-3-phenylpropan-1-ol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 184.065492738 u |
| Formula | C10H13ClO |
| InChI | InChI=1S/C10H13ClO/c1-10(11,8-12)7-9-5-3-2-4-6-9/h2-6,12H,7-8H2,1H3 |
| InChIKey | HLKKNIMVNJYHLQ-UHFFFAOYSA-N |
| Molecular Weight | 184.666 g/mol |
| SMILES | C(C(CC=1C=CC=CC1)(C)Cl)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.891592 |