| SpectraBase Compound ID | G7CWfrgcJ4J |
|---|---|
| InChI | InChI=1S/C9H14O4/c1-7(10)3-4-8(11)5-6-9(12)13-2/h3-6H2,1-2H3 |
| InChIKey | VGDSAPHYFMWWPS-UHFFFAOYSA-N |
| Mol Weight | 186.21 g/mol |
| Molecular Formula | C9H14O4 |
| Exact Mass | 186.089209 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2r6zQ7Pu0EX |
|---|---|
| Name | 4,7-DIONEOCTANOYC ACID, METHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H14O4 |
| InChI | InChI=1S/C9H14O4/c1-7(10)3-4-8(11)5-6-9(12)13-2/h3-6H2,1-2H3 |
| InChIKey | VGDSAPHYFMWWPS-UHFFFAOYSA-N |
| Molecular Weight | 186.0888 |
| SMILES | CC(CCC(CCC(OC)=O)=O)=O |
| SPLASH | splash10-052g-9200000000-2a75cb1c38b0da9b4ba4 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |