| SpectraBase Compound ID | BSBdoBKxZ3N |
|---|---|
| InChI | InChI=1S/C13H24O4/c1-10(2)11(3)17-13(15)9-7-5-6-8-12(14)16-4/h10-11H,5-9H2,1-4H3 |
| InChIKey | SLNNGRSNVOODRA-UHFFFAOYSA-N |
| Mol Weight | 244.33 g/mol |
| Molecular Formula | C13H24O4 |
| Exact Mass | 244.167459 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7wdciB7bcTJ |
|---|---|
| Name | Pimelic acid, 3-methylbut-2-yl methyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H24O4 |
| InChI | InChI=1S/C13H24O4/c1-10(2)11(3)17-13(15)9-7-5-6-8-12(14)16-4/h10-11H,5-9H2,1-4H3 |
| InChIKey | SLNNGRSNVOODRA-UHFFFAOYSA-N |
| Molecular Weight | 244.331 g/mol |
| SMILES | C(CCCCCC(OC(C(C)C)C)=O)(OC)=O |
| SPLASH | splash10-0a4i-6900000000-c619a7ce20e182f9c9ae |
| Source of Spectrum | TIPS-2022-995-0 |
| Wiley ID | 1822512 |