| SpectraBase Compound ID | 8LmZ68NohnH |
|---|---|
| InChI | InChI=1S/C13H17ClO2/c1-11(9-10-16-13(14)15)7-8-12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3 |
| InChIKey | RENZZSYFEAUNOS-UHFFFAOYSA-N |
| Mol Weight | 240.73 g/mol |
| Molecular Formula | C13H17ClO2 |
| Exact Mass | 240.091707 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DPs1mslvPys |
|---|---|
| Name | 3-Methyl-5-phenylpentyl carbonochloridate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 240.091707485 u |
| Formula | C13H17ClO2 |
| InChI | InChI=1S/C13H17ClO2/c1-11(9-10-16-13(14)15)7-8-12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3 |
| InChIKey | RENZZSYFEAUNOS-UHFFFAOYSA-N |
| Molecular Weight | 240.730 g/mol |
| SMILES | C(=O)(OCCC(CCC=1C=CC=CC1)C)Cl |