| SpectraBase Compound ID | Lc2AxtxuAgZ |
|---|---|
| InChI | InChI=1S/C17H25O7.3C4H9.Sn/c1-8-9(7-10(18)20-6)12-14(23-16(2,3)21-12)15-13(11(8)19)22-17(4,5)24-15;3*1-3-4-2;/h1,9,11-15,19H,7H2,2-6H3;3*1,3-4H2,2H3;/t9-,11+,12+,13-,14-,15-;;;;/m1..../s1 |
| InChIKey | AEPSAFPUMPYYRN-MPAJPKHFSA-N |
| Mol Weight | 631.4 g/mol |
| Molecular Formula | C29H52O7Sn |
| Exact Mass | 632.273506 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | zUzxT6AANz |
|---|---|
| Name | Methyl .alpha.{2,3:,4,5-Bis(isopropylidenedioxy)-6-hydroxy-7-(tributylstannylmethylene)cycloheptyl}acetate isomer |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H52O7Sn |
| InChI | InChI=1S/C17H25O7.3C4H9.Sn/c1-8-9(7-10(18)20-6)12-14(23-16(2,3)21-12)15-13(11(8)19)22-17(4,5)24-15;3*1-3-4-2;/h1,9,11-15,19H,7H2,2-6H3;3*1,3-4H2,2H3;/t9-,11+,12+,13-,14-,15-;;;;/m1..../s1 |
| InChIKey | AEPSAFPUMPYYRN-MPAJPKHFSA-N |
| Molecular Weight | 631.439 g/mol |
| SMILES | O[C@@]1([C@@]2([C@@](OC(O2)(C)C)([C@]2([C@]([C@@](\C1=C/[Sn](CCCC)(CCCC)CCCC)(CC(=O)OC)[H])(OC(C)(C)O2)[H])[H])[H])[H])[H] |
| SPLASH | splash10-056r-5340290000-c0610d33fca8334953e5 |
| Source of Spectrum | J-67-3716-56 |
| Wiley ID | 1569910 |