![(-)-(3R,4R,5R)-3-(3',4'-DIMETHOXYBENZYL)-4-[3'',4''-DIMETHOXY-ALPHA,ALPHA-BIS-(PHENYLTHIO)-BENZYL]-5-(1-MENTHYLOXY)-BUTYROLACTONE](/api/spectrum/HjWPjqx0zR/structure.png?h=300&w=458 "(-)-(3R,4R,5R)-3-(3',4'-DIMETHOXYBENZYL)-4-[3'',4''-DIMETHOXY-ALPHA,ALPHA-BIS-(PHENYLTHIO)-BENZYL]-5-(1-MENTHYLOXY)-BUTYROLACTONE")
| SpectraBase Compound ID | GM080Fr9LG3 |
|---|---|
| InChI | InChI=1S/C43H48O7S2/c1-27(2)33-19-16-28(3)22-37(33)49-42-40(34(41(44)50-42)23-29-17-20-36-39(24-29)48-26-47-36)43(51-31-12-8-6-9-13-31,52-32-14-10-7-11-15-32)30-18-21-35(45-4)38(25-30)46-5/h6-15,17-18,20-21,24-25,27-28,33-34,37,40,42H,16,19,22-23,26H2,1-5H3/t28?,33?,34-,37?,40-,42-/m0/s1 |
| InChIKey | HQRHEUBUCAUAMZ-AXIUFWETSA-N |
| Mol Weight | 741.0 g/mol |
| Molecular Formula | C43H48O7S2 |
| Exact Mass | 740.284146 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HjWPjqx0zR |
|---|---|
| Name | (-)-(3R,4R,5R)-3-(3',4'-DIMETHOXYBENZYL)-4-[3'',4''-DIMETHOXY-ALPHA,ALPHA-BIS-(PHENYLTHIO)-BENZYL]-5-(1-MENTHYLOXY)-BUTYROLACTONE |
| Compound Number | 2B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C43H48O7S2 |
| InChI | InChI=1S/C43H48O7S2/c1-27(2)33-19-16-28(3)22-37(33)49-42-40(34(41(44)50-42)23-29-17-20-36-39(24-29)48-26-47-36)43(51-31-12-8-6-9-13-31,52-32-14-10-7-11-15-32)30-18-21-35(45-4)38(25-30)46-5/h6-15,17-18,20-21,24-25,27-28,33-34,37,40,42H,16,19,22-23,26H2,1-5H3/t28?,33?,34-,37?,40-,42-/m0/s1 |
| InChIKey | HQRHEUBUCAUAMZ-AXIUFWETSA-N |
| Literature Reference Author | A.PELTER,R.S.WARD,D.M.JONES,P.MADDOCKS |
| Literature Reference Citation | J.CHEM.SOC.PERKIN-1,2631(1993) |
| Literature Reference DOI | 10.1039/p19930002631 |
| Molecular Weight | 740.970 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWRU4117 |