| SpectraBase Compound ID | 9drTBgC72yC |
|---|---|
| InChI | InChI=1S/C10H17ClO3/c1-10(2,3)7-14-9(13)6-4-5-8(11)12/h4-7H2,1-3H3 |
| InChIKey | OIYIGOLXEBSCHQ-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 | 7VWCLnl9jv4 |
|---|---|
| Name | Glutaric acid, monochloride, neopentyl 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/c1-10(2,3)7-14-9(13)6-4-5-8(11)12/h4-7H2,1-3H3 |
| InChIKey | OIYIGOLXEBSCHQ-UHFFFAOYSA-N |
| Molecular Weight | 220.696 g/mol |
| SMILES | C(CCCC(OCC(C)(C)C)=O)(Cl)=O |