| SpectraBase Compound ID | FI6eCQYv2Ul |
|---|---|
| InChI | InChI=1S/C13H19Cl/c14-12-8-3-1-2-5-9-13-10-6-4-7-11-13/h4,6-7,10-11H,1-3,5,8-9,12H2 |
| InChIKey | PNUBJDFTMKBZJK-UHFFFAOYSA-N |
| Mol Weight | 210.75 g/mol |
| Molecular Formula | C13H19Cl |
| Exact Mass | 210.117528 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K2yFsazeXk4 |
|---|---|
| Name | (7-Chloroheptyl)benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 210.117528312 u |
| Formula | C13H19Cl |
| InChI | InChI=1S/C13H19Cl/c14-12-8-3-1-2-5-9-13-10-6-4-7-11-13/h4,6-7,10-11H,1-3,5,8-9,12H2 |
| InChIKey | PNUBJDFTMKBZJK-UHFFFAOYSA-N |
| Molecular Weight | 210.748 g/mol |
| SMILES | C=1C(CCCCCCCCl)=CC=CC1 |