| SpectraBase Compound ID | C0dJ7X0w43R |
|---|---|
| InChI | InChI=1S/C10H13Cl/c1-10(2,11)8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3 |
| InChIKey | YMKBSXVBAHEQHF-UHFFFAOYSA-N |
| Mol Weight | 168.67 g/mol |
| Molecular Formula | C10H13Cl |
| Exact Mass | 168.070578 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | K1QPSSPLaHp |
|---|---|
| Name | 2-Chloro-2-methyl-1-phenylpropane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 168.070578119 u |
| Formula | C10H13Cl |
| InChI | InChI=1S/C10H13Cl/c1-10(2,11)8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3 |
| InChIKey | YMKBSXVBAHEQHF-UHFFFAOYSA-N |
| Molecular Weight | 168.667 g/mol |
| SMILES | C=1C(=CC=CC1)CC(C)(Cl)C |
| Spectrum/Structure Validation Score (Raman) | 0.975106 |