| SpectraBase Compound ID | 1WknqBcQE0h |
|---|---|
| InChI | InChI=1S/C8H15ClO2/c1-6(5-9)4-7(2)8(10)11-3/h6-7H,4-5H2,1-3H3 |
| InChIKey | NADJOIDRRGGQLB-UHFFFAOYSA-N |
| Mol Weight | 178.66 g/mol |
| Molecular Formula | C8H15ClO2 |
| Exact Mass | 178.076057 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9egt4cB1vqI |
|---|---|
| Name | 5-CHLORO-2,4-DIMETHYLPENTANOIC ACID, METHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H15O2Cl |
| InChI | InChI=1S/C8H15ClO2/c1-6(5-9)4-7(2)8(10)11-3/h6-7H,4-5H2,1-3H3 |
| InChIKey | NADJOIDRRGGQLB-UHFFFAOYSA-N |
| Molecular Weight | 178.0757 |
| SMILES | C(Cl)C(CC(C(OC)=O)C)C |
| SPLASH | splash10-0kai-9200000000-9a16d5392a10fc687a05 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |