| SpectraBase Compound ID | AwOPM6iOFPW |
|---|---|
| InChI | InChI=1S/C27H30O5S/c1-15(2)20-13-22(17(5)11-24(20)28)27(19-9-7-8-10-26(19)33(30,31)32)23-14-21(16(3)4)25(29)12-18(23)6/h7-16,28H,1-6H3,(H,30,31,32) |
| InChIKey | KCQJYHASKWHRMM-UHFFFAOYSA-N |
| Mol Weight | 466.59 g/mol |
| Molecular Formula | C27H30O5S |
| Exact Mass | 466.181395 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BmvIPGBP5a9 |
|---|---|
| Name | alpha-(4-hydroxy-5-isopropyl-o-tolyl)-alpha-(5-isopropyl-2-methyl-4-oxo- 2,5-cyclohexadienylidene)-o-toluenesulfonic acid |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H30O5S |
| InChI | InChI=1S/C27H30O5S/c1-15(2)20-13-22(17(5)11-24(20)28)27(19-9-7-8-10-26(19)33(30,31)32)23-14-21(16(3)4)25(29)12-18(23)6/h7-16,28H,1-6H3,(H,30,31,32) |
| InChIKey | KCQJYHASKWHRMM-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 25711M |
| Solvent | Polysol-d |