| SpectraBase Compound ID | 8ywG2lET6JP |
|---|---|
| InChI | InChI=1S/C10H18O3/c1-8(7-13-10(3)12)5-4-6-9(2)11/h8H,4-7H2,1-3H3 |
| InChIKey | XBDGCKGXGCVOGY-UHFFFAOYSA-N |
| Mol Weight | 186.25 g/mol |
| Molecular Formula | C10H18O3 |
| Exact Mass | 186.125594 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7nfVW8YK5DC |
|---|---|
| Name | ACETIC ACID, 2-METHYL-6-OXOHEPTYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C10H18O3 |
| InChI | InChI=1S/C10H18O3/c1-8(7-13-10(3)12)5-4-6-9(2)11/h8H,4-7H2,1-3H3 |
| InChIKey | XBDGCKGXGCVOGY-UHFFFAOYSA-N |
| Molecular Weight | 186.1251 |
| SMILES | CC(OCC(CCCC(C)=O)C)=O |
| SPLASH | splash10-05mo-9200000000-3c68e960722efebbf0ab |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |