| SpectraBase Compound ID | 7wG25xuuiuY |
|---|---|
| InChI | InChI=1S/C13H26O2/c1-4-7-10-12(9-6-3)15-13(14)11-8-5-2/h12H,4-11H2,1-3H3 |
| InChIKey | CCMQUTNEAVHSMK-UHFFFAOYSA-N |
| Mol Weight | 214.35 g/mol |
| Molecular Formula | C13H26O2 |
| Exact Mass | 214.19328 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | lmSFuCg3kY |
|---|---|
| Name | VALERIC ACID, OCT-4-YL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C13H26O2 |
| InChI | InChI=1S/C13H26O2/c1-4-7-10-12(9-6-3)15-13(14)11-8-5-2/h12H,4-11H2,1-3H3 |
| InChIKey | CCMQUTNEAVHSMK-UHFFFAOYSA-N |
| Molecular Weight | 214.1926 |
| SMILES | CCCCC(OC(CCC)CCCC)=O |
| SPLASH | splash10-052u-9100000000-2f6d158aadd490bc89f7 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |