| SpectraBase Compound ID | HZ4kP8m2b9x |
|---|---|
| InChI | InChI=1S/C12H21ClO2/c1-10(7-8-15-12(3)14)5-4-6-11(2)9-13/h6,10H,4-5,7-9H2,1-3H3/b11-6+/t10-/m0/s1 |
| InChIKey | RZAYYBHOSZRQJC-OTXQMUPVSA-N |
| Mol Weight | 232.75 g/mol |
| Molecular Formula | C12H21ClO2 |
| Exact Mass | 232.123008 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G1hPl5j6Ya9 |
|---|---|
| Name | (S)-3,7-Dimethyl-8-chloro-6-octenyl acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 232.123007614 u |
| Formula | C12H21ClO2 |
| InChI | InChI=1S/C12H21ClO2/c1-10(7-8-15-12(3)14)5-4-6-11(2)9-13/h6,10H,4-5,7-9H2,1-3H3/b11-6+/t10-/m0/s1 |
| InChIKey | RZAYYBHOSZRQJC-OTXQMUPVSA-N |
| Molecular Weight | 232.751 g/mol |
| SMILES | C(=O)(OCC[C@](CC\C=C\(CCl)C)(C)[H])C |