| SpectraBase Compound ID | KrCWxcojG1W |
|---|---|
| InChI | InChI=1S/C42H54O6/c1-37(2)13-9-15-39(5)27(37)11-17-41(7)29(39)19-22-25(47-41)21-24(44)34-30(22)32-31-26(20-23(43)33(32)45)48-42(8)18-12-28-38(3,4)14-10-16-40(28,6)36(42)35(31)46-34/h19-21,27-28,35-36,43-45H,9-18H2,1-8H3/t27-,28-,35+,36+,39-,40-,41-,42-/m0/s1 |
| InChIKey | YHBNZAXDVRIVFN-AGEOKJENSA-N |
| Mol Weight | 654.9 g/mol |
| Molecular Formula | C42H54O6 |
| Exact Mass | 654.392039 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 10LL86hVnkl |
|---|---|
| Name | DIPUUPEHETRIOL |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H54O6 |
| InChI | InChI=1S/C42H54O6/c1-37(2)13-9-15-39(5)27(37)11-17-41(7)29(39)19-22-25(47-41)21-24(44)34-30(22)32-31-26(20-23(43)33(32)45)48-42(8)18-12-28-38(3,4)14-10-16-40(28,6)36(42)35(31)46-34/h19-21,27-28,35-36,43-45H,9-18H2,1-8H3/t27-,28-,35+,36+,39-,40-,41-,42-/m0/s1 |
| InChIKey | YHBNZAXDVRIVFN-AGEOKJENSA-N |
| Literature Reference Author | M.T.HAMANN,P.J.SCHEUER,M.KELLY-BORGES |
| Literature Reference Citation | J.ORG.CHEM.,58,6565(1993) |
| Literature Reference DOI | 10.1021/jo00076a012 |
| Molecular Weight | 654.887 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWGE2324 |