| SpectraBase Compound ID | GPbVGJNE4cI |
|---|---|
| InChI | InChI=1S/C9H16O4/c1-12-8(10)6-4-3-5-7-9(11)13-2/h3-7H2,1-2H3 |
| InChIKey | SHWINQXIGSEZAP-UHFFFAOYSA-N |
| Mol Weight | 188.22 g/mol |
| Molecular Formula | C9H16O4 |
| Exact Mass | 188.104859 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DAirunP7f3l |
|---|---|
| Name | HEPTANEDIOIC ACID, DIMETHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H16O4 |
| InChI | InChI=1S/C9H16O4/c1-12-8(10)6-4-3-5-7-9(11)13-2/h3-7H2,1-2H3 |
| InChIKey | SHWINQXIGSEZAP-UHFFFAOYSA-N |
| Instrument Name | 311A |
| Molecular Weight | 188.1044 |
| SMILES | COC(CCCCCC(OC)=O)=O |
| SPLASH | splash10-06dl-9300000000-b814e0a8c4de2f556b80 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |