| SpectraBase Compound ID | LjDB6jCftmc |
|---|---|
| InChI | InChI=1S/C6H9Cl3O3/c1-2-12-5(11)3-4(10)6(7,8)9/h4,10H,2-3H2,1H3 |
| InChIKey | RZSBEAZIKBJBBY-UHFFFAOYSA-N |
| Mol Weight | 235.49 g/mol |
| Molecular Formula | C6H9Cl3O3 |
| Exact Mass | 233.961727 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8MO1iWDVJA8 |
|---|---|
| Name | BUTANOIC ACID, 4,4,4-TRICHLORO-3-HYDROXY-, ETHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C6H9O3Cl3 |
| InChI | InChI=1S/C6H9Cl3O3/c1-2-12-5(11)3-4(10)6(7,8)9/h4,10H,2-3H2,1H3 |
| InChIKey | RZSBEAZIKBJBBY-UHFFFAOYSA-N |
| Molecular Weight | 233.9616 |
| SMILES | OC(C(Cl)(Cl)Cl)CC(=O)OCC |
| SPLASH | splash10-0103-9400000000-dc22497ba0f3d6e6e5e7 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |