| SpectraBase Compound ID | J5cqaHp3hbS |
|---|---|
| InChI | InChI=1S/C16H32O4/c1-8-12(20-13(17)9-2)10(3)14(18)11(4)15(19)16(5,6)7/h10-12,14-15,18-19H,8-9H2,1-7H3/t10-,11+,12-,14+,15+/m1/s1 |
| InChIKey | AZZUVLRBPIQFBE-MIBAYGRRSA-N |
| Mol Weight | 288.4 g/mol |
| Molecular Formula | C16H32O4 |
| Exact Mass | 288.23006 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Fvrj85IdgHx |
|---|---|
| Name | (3RS,4SR,5RS,6SR,7SR)-5,7-Dihydroxy-4,6,8,8-tetramethylnonan-3-yl propionate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H32O4 |
| InChI | InChI=1S/C16H32O4/c1-8-12(20-13(17)9-2)10(3)14(18)11(4)15(19)16(5,6)7/h10-12,14-15,18-19H,8-9H2,1-7H3/t10-,11+,12-,14+,15+/m1/s1 |
| InChIKey | AZZUVLRBPIQFBE-MIBAYGRRSA-N |
| Molecular Weight | 288.428 g/mol |
| SMILES | O[C@]([C@@]([C@@](C(C)(C)C)(O)[H])(C)[H])([C@@]([C@](OC(=O)CC)(CC)[H])(C)[H])[H] |
| SPLASH | splash10-0a59-9140000000-60226e05e7c1373166f3 |
| Source of Spectrum | KC-0-2268-11 |
| Synonyms | 1-Ethyl-3,5-dihydroxy-2,4,6,6-tetramethylheptyl propionate Propionic acid (1R,2S,3R,4S,5S)-1-ethyl-3,5-dihydroxy-2,4,6,6-tetramethyl-heptyl ester Propanoic acid [(3R,4S,5R,6S,7S)-5,7-dihydroxy-4,6,8,8-tetramethylnonan-3-yl] ester [(3R,4S,5R,6S,7S)-5,7-dihydroxy-4,6,8,8-tetramethylnonan-3-yl] propanoate [(1R,2S,3R,4S,5S)-1-ethyl-3,5-dihydroxy-2,4,6,6-tetramethyl-heptyl] propanoate [(3R,4S,5R,6S,7S)-4,6,8,8-tetramethyl-5,7-bis(oxidanyl)nonan-3-yl] propanoate |
| Wiley ID | 831294 |