| SpectraBase Compound ID | Dl9R9FFfeay |
|---|---|
| InChI | InChI=1S/C24H34O6/c1-16-10-12-24(29-16)13-11-17(30-24)8-6-4-5-7-9-20-19-14-18(26-2)15-21(27-3)22(19)23(25)28-20/h14-17,20H,4-13H2,1-3H3/t16-,17-,20-,24-/m0/s1 |
| InChIKey | MDVWGBKYBVEXHU-MEICDQCUSA-N |
| Mol Weight | 418.5 g/mol |
| Molecular Formula | C24H34O6 |
| Exact Mass | 418.235539 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | G45ZDmFzoKa |
|---|---|
| Name | CJ-12,954 |
| Alternate Name(s) | (3'E,2''S,5''S,7''S)-5,7-Dimethoxy-3-[6'-(2''-methyl-1'',6''-dioxaspiro[4.4]non-7''-yl)hex-1'-yl]-3H-isobenzofuran-1-one (3'E,2''S,5''S,7''S)-5,7-Dimethoxy-3-[6'-(7''-methyl-1'',6''-dioxa-spiro[4.4]non-2''-yl)hex-1'-yl]-3H-isobenzofuran-1-one (S)-5,7-dimethoxy-3-(6-((2S,5S,7S)-7-methyl-1,6-dioxaspiro[4.4]nonan-2-yl)hexyl)isobenzofuran-1(3H)-one (3S)-5,7-dimethoxy-3-[6-[(2S,5S,7S)-7-methyl-1,6-dioxaspiro[4.4]nonan-2-yl]hexyl]-3H-isobenzofuran-1-one (3S)-5,7-dimethoxy-3-[6-[(2S,5S,7S)-7-methyl-1,6-dioxaspiro[4.4]nonan-2-yl]hexyl]-3H-2-benzofuran-1-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C24H34O6 |
| InChI | InChI=1S/C24H34O6/c1-16-10-12-24(29-16)13-11-17(30-24)8-6-4-5-7-9-20-19-14-18(26-2)15-21(27-3)22(19)23(25)28-20/h14-17,20H,4-13H2,1-3H3/t16-,17-,20-,24-/m0/s1 |
| InChIKey | MDVWGBKYBVEXHU-MEICDQCUSA-N |
| Molecular Weight | 418.530 g/mol |
| SMILES | c12C(O[C@](c2cc(cc1OC)OC)(CCCCCC[C@@]1(O[C@]2(O[C@@](C)(CC2)[H])CC1)[H])[H])=O |
| SPLASH | splash10-0006-2913000000-6d8ff8683b72b1de8a0c |
| Source of Spectrum | F5-5-2865-1a |
| Wiley ID | 1733291 |