| SpectraBase Compound ID | ByPa6iEQkgq |
|---|---|
| InChI | InChI=1S/C10H17ClO3/c1-3-4-5-8(2)14-10(13)7-6-9(11)12/h8H,3-7H2,1-2H3 |
| InChIKey | RUIXFGUNJBUFDS-UHFFFAOYSA-N |
| Mol Weight | 220.7 g/mol |
| Molecular Formula | C10H17ClO3 |
| Exact Mass | 220.086622 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Egd8oNmrX0x |
|---|---|
| Name | Succinic acid, monochloride, 2-hexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 220.086622104 u |
| Formula | C10H17ClO3 |
| InChI | InChI=1S/C10H17ClO3/c1-3-4-5-8(2)14-10(13)7-6-9(11)12/h8H,3-7H2,1-2H3 |
| InChIKey | RUIXFGUNJBUFDS-UHFFFAOYSA-N |
| Molecular Weight | 220.696 g/mol |
| SMILES | C(C(OC(C)CCCC)=O)CC(Cl)=O |