| SpectraBase Compound ID | Edfgp2zBWo4 |
|---|---|
| InChI | InChI=1S/C15H28O4/c1-4-9-13(10-5-2)19-15(17)12-8-6-7-11-14(16)18-3/h13H,4-12H2,1-3H3 |
| InChIKey | MSJGVNAOTBGKHX-UHFFFAOYSA-N |
| Mol Weight | 272.38 g/mol |
| Molecular Formula | C15H28O4 |
| Exact Mass | 272.198759 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9GxvYA7iwdS |
|---|---|
| Name | Pimelic acid, 4-heptyl methyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H28O4 |
| InChI | InChI=1S/C15H28O4/c1-4-9-13(10-5-2)19-15(17)12-8-6-7-11-14(16)18-3/h13H,4-12H2,1-3H3 |
| InChIKey | MSJGVNAOTBGKHX-UHFFFAOYSA-N |
| Molecular Weight | 272.385 g/mol |
| SMILES | C(CCCCCC(OC(CCC)CCC)=O)(OC)=O |
| SPLASH | splash10-0a4i-6900000000-5b41cd8d8a5402074eb9 |
| Source of Spectrum | TIPS-2022-817-0 |
| Wiley ID | 1822334 |