| SpectraBase Compound ID | L8VR5GFe7OJ |
|---|---|
| InChI | InChI=1S/C15H21ClO2/c1-3-4-5-6-8-12(2)18-15(17)13-9-7-10-14(16)11-13/h7,9-12H,3-6,8H2,1-2H3 |
| InChIKey | DRJCEVLJJXITPT-UHFFFAOYSA-N |
| Mol Weight | 268.78 g/mol |
| Molecular Formula | C15H21ClO2 |
| Exact Mass | 268.123008 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3zg4kxt1uFY |
|---|---|
| Name | Octan-2-yl 3-chlorobenzoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 268.123007614 u |
| Formula | C15H21ClO2 |
| InChI | InChI=1S/C15H21ClO2/c1-3-4-5-6-8-12(2)18-15(17)13-9-7-10-14(16)11-13/h7,9-12H,3-6,8H2,1-2H3 |
| InChIKey | DRJCEVLJJXITPT-UHFFFAOYSA-N |
| SMILES | C(=O)(C1=CC(=CC=C1)Cl)OC(C)CCCCCC |