| SpectraBase Compound ID | Ie61FWl0Id7 |
|---|---|
| InChI | InChI=1S/C15H30O4/c1-7-12(19-13(16)8-2)10(5)15(18)11(6)14(17)9(3)4/h9-12,14-15,17-18H,7-8H2,1-6H3/t10-,11-,12-,14-,15+/m1/s1 |
| InChIKey | JPFSAPKPNZFLLT-FWZIUSJTSA-N |
| Mol Weight | 274.4 g/mol |
| Molecular Formula | C15H30O4 |
| Exact Mass | 274.214409 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 40SDGFyDQm |
|---|---|
| Name | (3RS,4SR,5RS,6RS,7RS)-5,7-Dihydroxy-4,6,8-trimethylnonan-3-yl propionate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H30O4 |
| InChI | InChI=1S/C15H30O4/c1-7-12(19-13(16)8-2)10(5)15(18)11(6)14(17)9(3)4/h9-12,14-15,17-18H,7-8H2,1-6H3/t10-,11-,12-,14-,15+/m1/s1 |
| InChIKey | JPFSAPKPNZFLLT-FWZIUSJTSA-N |
| Molecular Weight | 274.401 g/mol |
| SMILES | O[C@]([C@@]([C@@](C(C)C)(O)[H])(C)[H])([C@@]([C@](OC(=O)CC)(CC)[H])(C)[H])[H] |
| SPLASH | splash10-0ars-9450000000-78187c7ad2303d39e504 |
| Source of Spectrum | KC-0-2268-9 |
| Synonyms | 1-Ethyl-3,5-dihydroxy-2,4,6-trimethylheptyl propionate Propionic acid (1R,2S,3R,4R,5R)-1-ethyl-3,5-dihydroxy-2,4,6-trimethyl-heptyl ester Propanoic acid [(3R,4S,5R,6R,7R)-5,7-dihydroxy-4,6,8-trimethylnonan-3-yl] ester [(3R,4S,5R,6R,7R)-5,7-dihydroxy-4,6,8-trimethylnonan-3-yl] propanoate [(1R,2S,3R,4R,5R)-1-ethyl-3,5-dihydroxy-2,4,6-trimethyl-heptyl] propanoate [(3R,4S,5R,6R,7R)-4,6,8-trimethyl-5,7-bis(oxidanyl)nonan-3-yl] propanoate |
| Wiley ID | 831296 |