| SpectraBase Compound ID | FVk8Redptij |
|---|---|
| InChI | InChI=1S/C13H17ClO/c1-2-3-4-5-6-11-7-9-12(10-8-11)13(14)15/h7-10H,2-6H2,1H3 |
| InChIKey | XRAHLPNMIIAEPP-UHFFFAOYSA-N |
| Mol Weight | 224.73 g/mol |
| Molecular Formula | C13H17ClO |
| Exact Mass | 224.096793 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9I3qQgc5fBg |
|---|---|
| Name | 4-N-Hexylbenzoyl chloride |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 224.096792866 u |
| Formula | C13H17ClO |
| InChI | InChI=1S/C13H17ClO/c1-2-3-4-5-6-11-7-9-12(10-8-11)13(14)15/h7-10H,2-6H2,1H3 |
| InChIKey | XRAHLPNMIIAEPP-UHFFFAOYSA-N |
| Molecular Weight | 224.731 g/mol |
| SMILES | C1=CC(=CC=C1C(Cl)=O)CCCCCC |