![METHYL-[1R-(1-ALPHA,4A-BETA,5-BETA,6-ALPHA,8A-ALPHA)]-DECAHYDRO-6-(4-METHYLBENZENESULFOXY)-METHYL-1,4A-DIMETHYL-5-(4-METHYL-3-OXOPENTYL)-NAPHTHALE](/api/spectrum/5YeYr9OcX34/structure.png?h=300&w=458 "METHYL-[1R-(1-ALPHA,4A-BETA,5-BETA,6-ALPHA,8A-ALPHA)]-DECAHYDRO-6-(4-METHYLBENZENESULFOXY)-METHYL-1,4A-DIMETHYL-5-(4-METHYL-3-OXOPENTYL)-NAPHTHALE")
| SpectraBase Compound ID | 4gy6tgeSE2G |
|---|---|
| InChI | InChI=1S/C28H42O6S/c1-19(2)24(29)14-13-23-21(18-34-35(31,32)22-11-8-20(3)9-12-22)10-15-25-27(23,4)16-7-17-28(25,5)26(30)33-6/h8-9,11-12,19,21,23,25H,7,10,13-18H2,1-6H3/t21-,23-,25+,27+,28+/m0/s1 |
| InChIKey | QLLPGVUNBJQUDO-VALHTMQASA-N |
| Mol Weight | 506.7 g/mol |
| Molecular Formula | C28H42O6S |
| Exact Mass | 506.27021 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5YeYr9OcX34 |
|---|---|
| Name | METHYL-[1R-(1-ALPHA,4A-BETA,5-BETA,6-ALPHA,8A-ALPHA)]-DECAHYDRO-6-(4-METHYLBENZENESULFOXY)-METHYL-1,4A-DIMETHYL-5-(4-METHYL-3-OXOPENTYL)-NAPHTHALE |
| Compound Number | 19 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H42O6S |
| InChI | InChI=1S/C28H42O6S/c1-19(2)24(29)14-13-23-21(18-34-35(31,32)22-11-8-20(3)9-12-22)10-15-25-27(23,4)16-7-17-28(25,5)26(30)33-6/h8-9,11-12,19,21,23,25H,7,10,13-18H2,1-6H3/t21-,23-,25+,27+,28+/m0/s1 |
| InChIKey | QLLPGVUNBJQUDO-VALHTMQASA-N |
| Literature Reference Author | E.HASLINGER,A.HUEFNER |
| Literature Reference Citation | MH.CHEM.,126,1109(1995) |
| Literature Reference DOI | 10.1007/BF00811381 |
| Molecular Weight | 506.698 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWGN15 |