| SpectraBase Compound ID | 9FxJEd9CFxo |
|---|---|
| InChI | InChI=1S/C12H22O4/c1-9(6-5-7-11(13)15-3)8-10(2)12(14)16-4/h9-10H,5-8H2,1-4H3 |
| InChIKey | ARDWIKBFRMKLRR-UHFFFAOYSA-N |
| Mol Weight | 230.3 g/mol |
| Molecular Formula | C12H22O4 |
| Exact Mass | 230.151809 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7WewNMsA4i7 |
|---|---|
| Name | OCTANEDIOIC ACID, 2,4-DIMETHYL-, DIMETHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C12H22O4 |
| InChI | InChI=1S/C12H22O4/c1-9(6-5-7-11(13)15-3)8-10(2)12(14)16-4/h9-10H,5-8H2,1-4H3 |
| InChIKey | ARDWIKBFRMKLRR-UHFFFAOYSA-N |
| Molecular Weight | 230.1512 |
| SMILES | COC(C(C)CC(C)CCCC(=O)OC)=O |
| SPLASH | splash10-05mx-9400000000-bd6942aaa3b6bf01a47a |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |