![#30;(3AS*,4R*,7R*,7AS*)-1,2,3,3A,4,6,7,7A-OCTAHYDRO-7-[2-(2-METHYL-1,3-DIOXOLAN-2-YL)-ETHYL]-1,3-DIOXO-2-PHENYL-SPIRO-[4,7-ETHANOTHIOPYRANO-[3,4-C]-PYRROLE-8,2](/api/spectrum/ERGWiixrOg4/structure.png?h=300&w=458 "#30;(3AS*,4R*,7R*,7AS*)-1,2,3,3A,4,6,7,7A-OCTAHYDRO-7-[2-(2-METHYL-1,3-DIOXOLAN-2-YL)-ETHYL]-1,3-DIOXO-2-PHENYL-SPIRO-[4,7-ETHANOTHIOPYRANO-[3,4-C]-PYRROLE-8,2")
| SpectraBase Compound ID | 9oOWss1Bqr2 |
|---|---|
| InChI | InChI=1S/C23H27NO6S/c1-21(27-9-10-28-21)7-8-22-14-31-16(13-23(22)29-11-12-30-23)17-18(22)20(26)24(19(17)25)15-5-3-2-4-6-15/h2-6,16-18H,7-14H2,1H3/t16-,17+,18-,22-/m1/s1 |
| InChIKey | SSVUFKBSHWOGBK-WYADAEROSA-N |
| Mol Weight | 445.53 g/mol |
| Molecular Formula | C23H27NO6S |
| Exact Mass | 445.155909 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ERGWiixrOg4 |
|---|---|
| Name | #30;(3AS*,4R*,7R*,7AS*)-1,2,3,3A,4,6,7,7A-OCTAHYDRO-7-[2-(2-METHYL-1,3-DIOXOLAN-2-YL)-ETHYL]-1,3-DIOXO-2-PHENYL-SPIRO-[4,7-ETHANOTHIOPYRANO-[3,4-C]-PYRROLE-8,2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C23H27NO6S |
| InChI | InChI=1S/C23H27NO6S/c1-21(27-9-10-28-21)7-8-22-14-31-16(13-23(22)29-11-12-30-23)17-18(22)20(26)24(19(17)25)15-5-3-2-4-6-15/h2-6,16-18H,7-14H2,1H3/t16-,17+,18-,22-/m1/s1 |
| InChIKey | SSVUFKBSHWOGBK-WYADAEROSA-N |
| Literature Reference Author | D.E.WARD,Y.GAI |
| Literature Reference Citation | CAN.J.CHEM.,75,681(1997) |
| Literature Reference DOI | 10.1139/v97-082 |
| Molecular Weight | 445.530 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCP5027 |