| SpectraBase Compound ID | HEX11fl0AnP |
|---|---|
| InChI | InChI=1S/C17H34O4/c1-9(2)14(18)12(7)15(19)13(8)16(10(3)4)21-17(20)11(5)6/h9-16,18-19H,1-8H3/t12-,13+,14-,15-,16-/m1/s1 |
| InChIKey | QSVHGWMEZPGRLQ-YIDVYQOGSA-N |
| Mol Weight | 302.5 g/mol |
| Molecular Formula | C17H34O4 |
| Exact Mass | 302.24571 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2let6EnG5o |
|---|---|
| Name | (3RS,4SR,5RS,6RS,7RS)-5,7-Dihydroxy-2,4,6,8-tetramethylnonan-3-yl isobutyrate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H34O4 |
| InChI | InChI=1S/C17H34O4/c1-9(2)14(18)12(7)15(19)13(8)16(10(3)4)21-17(20)11(5)6/h9-16,18-19H,1-8H3/t12-,13+,14-,15-,16-/m1/s1 |
| InChIKey | QSVHGWMEZPGRLQ-YIDVYQOGSA-N |
| Molecular Weight | 302.455 g/mol |
| SMILES | O[C@@]([C@]([C@]([C@@]([C@](OC(=O)C(C)C)(C(C)C)[H])(C)[H])(O)[H])(C)[H])(C(C)C)[H] |
| SPLASH | splash10-0230-9610000000-3fc44c7e3d0bb85ac7bb |
| Source of Spectrum | KC-0-2269-15 |
| Synonyms | 3,5-Dihydroxy-1-isopropyl-2,4,6-trimethylheptyl 2-methylpropanoate Isobutyric acid (1R,2S,3R,4R,5R)-3,5-dihydroxy-1-isopropyl-2,4,6-trimethyl-heptyl ester 2-Methylpropanoic acid [(3R,4S,5R,6R,7R)-5,7-dihydroxy-2,4,6,8-tetramethylnonan-3-yl] ester [(3R,4S,5R,6R,7R)-5,7-dihydroxy-2,4,6,8-tetramethylnonan-3-yl] 2-methylpropanoate [(1R,2S,3R,4R,5R)-3,5-dihydroxy-1-isopropyl-2,4,6-trimethyl-heptyl] 2-methylpropanoate [(3R,4S,5R,6R,7R)-2,4,6,8-tetramethyl-5,7-bis(oxidanyl)nonan-3-yl] 2-methylpropanoate |
| Wiley ID | 831290 |