| SpectraBase Compound ID | 7E2G5g3nIeB |
|---|---|
| InChI | InChI=1S/C9H18O2/c1-3-4-5-6-7-8-9(10)11-2/h3-8H2,1-2H3 |
| InChIKey | JGHZJRVDZXSNKQ-UHFFFAOYSA-N |
| Mol Weight | 158.24 g/mol |
| Molecular Formula | C9H18O2 |
| Exact Mass | 158.13068 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | B2iTh42FD1c |
|---|---|
| Name | Octanoic acid methyl ester |
| Comments | MONAID: JP001291 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H18O2 |
| InChI | InChI=1S/C9H18O2/c1-3-4-5-6-7-8-9(10)11-2/h3-8H2,1-2H3 |
| InChIKey | JGHZJRVDZXSNKQ-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 158.241 g/mol |
| SMILES | C(CCCCCCC)(=O)OC |
| SPLASH | splash10-00di-9000000000-6eb28d1ab0d5d0c0ac02 |
| Source of Spectrum | SRH-2022-1291-0 |
| Synonyms | Methyl octanoate |
| Wiley ID | 1823729 |