| SpectraBase Compound ID | D20tj1gOLog |
|---|---|
| InChI | InChI=1S/C16H30O4/c1-5-10-14(6-2)20-16(18)12-9-7-8-11-15(17)19-13(3)4/h13-14H,5-12H2,1-4H3 |
| InChIKey | HOMNRQROJMAWFC-UHFFFAOYSA-N |
| Mol Weight | 286.41 g/mol |
| Molecular Formula | C16H30O4 |
| Exact Mass | 286.214409 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1djhrpZRYEW |
|---|---|
| Name | Pimelic acid, hex-3-yl isopropyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H30O4 |
| InChI | InChI=1S/C16H30O4/c1-5-10-14(6-2)20-16(18)12-9-7-8-11-15(17)19-13(3)4/h13-14H,5-12H2,1-4H3 |
| InChIKey | HOMNRQROJMAWFC-UHFFFAOYSA-N |
| Molecular Weight | 286.412 g/mol |
| SMILES | C(CCCCCC(OC(CCC)CC)=O)(OC(C)C)=O |
| SPLASH | splash10-0006-6900000000-9ba1c57c94010979e1a2 |
| Source of Spectrum | TIPS-2022-956-0 |
| Wiley ID | 1822473 |