| SpectraBase Compound ID | Kf9eUBuhWQR |
|---|---|
| InChI | InChI=1S/C10H13Cl/c1-9(7-8-11)10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3 |
| InChIKey | UANCUAZOWOJXPU-UHFFFAOYSA-N |
| Mol Weight | 168.67 g/mol |
| Molecular Formula | C10H13Cl |
| Exact Mass | 168.070578 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BiZIdjVcUFB |
|---|---|
| Name | 1-Chloro-3-phenylbutane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 168.070578119 u |
| Formula | C10H13Cl |
| InChI | InChI=1S/C10H13Cl/c1-9(7-8-11)10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3 |
| InChIKey | UANCUAZOWOJXPU-UHFFFAOYSA-N |
| Molecular Weight | 168.667 g/mol |
| SMILES | C=1C(=CC=CC1)C(CCCl)C |