![syn-2,3,13,14-Tetra(methoxycarbonyl)-7,7'-dioxabisbicyclo[2.2.1]hept-2-eno[5,6-b:5',6'-b']bisbicyclo[2.2.2]oct-7-eno[5,6-b:5',6'-f]tricyclo[4.2.0.0(2,5)]octane](/api/spectrum/2krqIUrljM9/structure.png?h=300&w=458 "syn-2,3,13,14-Tetra(methoxycarbonyl)-7,7'-dioxabisbicyclo[2.2.1]hept-2-eno[5,6-b:5',6'-b']bisbicyclo[2.2.2]oct-7-eno[5,6-b:5',6'-f]tricyclo[4.2.0.0(2,5)]octane")
| SpectraBase Compound ID | Dbs2CsSQjPl |
|---|---|
| InChI | InChI=1S/C36H36O10/c1-41-33(37)25-26(34(38)42-2)30-18-10-6-5-9(17(18)29(25)45-30)13-14(10)22-21(13)23-15-11-7-8-12(16(15)24(22)23)20-19(11)31-27(35(39)43-3)28(32(20)46-31)36(40)44-4/h5-24,29-32H,1-4H3/t9-,10+,11+,12-,13+,14-,15?,16?,17-,18+,19+,20-,21?,22?,23?,24?,29-,30+,31+,32- |
| InChIKey | PSRHMLSPDGWFKF-AEVGDOAJSA-N |
| Mol Weight | 628.7 g/mol |
| Molecular Formula | C36H36O10 |
| Exact Mass | 628.230847 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2krqIUrljM9 |
|---|---|
| Name | syn-2,3,13,14-Tetra(methoxycarbonyl)-7,7'-dioxabisbicyclo[2.2.1]hept-2-eno[5,6-b:5',6'-b']bisbicyclo[2.2.2]oct-7-eno[5,6-b:5',6'-f]tricyclo[4.2.0.0(2,5)]octane |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C36H36O10 |
| InChI | InChI=1S/C36H36O10/c1-41-33(37)25-26(34(38)42-2)30-18-10-6-5-9(17(18)29(25)45-30)13-14(10)22-21(13)23-15-11-7-8-12(16(15)24(22)23)20-19(11)31-27(35(39)43-3)28(32(20)46-31)36(40)44-4/h5-24,29-32H,1-4H3/t9-,10+,11+,12-,13+,14-,15?,16?,17-,18+,19+,20-,21?,22?,23?,24?,29-,30+,31+,32- |
| InChIKey | PSRHMLSPDGWFKF-AEVGDOAJSA-N |
| Molecular Weight | 628.674 g/mol |
| SMILES | C1(=C([C@]2([C@@]3([C@]4(C5C6C7[C@@]8([C@]9([C@@]%10([C@]%11(C(C(=O)OC)=C([C@@]([C@@]%10([C@@]([C@@]8(C7C6C5[C@@]([C@@]3([C@@]1(O2)[H])[H])(C=C4)[H])[H])(C=C9)[H])[H])(O%11)[H])C(=O)OC)[H])[H])[H])[H])[H])[H])[H])C(=O)OC)C(=O)OC |
| SPLASH | splash10-0udi-2900000000-a5258d1a7f771b9830e9 |
| Source of Spectrum | AJ-68-2676-13 |
| Wiley ID | 773391 |