![(E)-1-((R)-2-((S)-2-Methyl-1-(triethylsilyloxy)propyl)cyclohexylidene)-1-[(S)-N-methyl-S-phenyl-sulfonimidoyl)]-hex-5-en-2-one](/api/spectrum/B2XysEyYcvg/structure.png?h=300&w=458 "(E)-1-((R)-2-((S)-2-Methyl-1-(triethylsilyloxy)propyl)cyclohexylidene)-1-[(S)-N-methyl-S-phenyl-sulfonimidoyl)]-hex-5-en-2-one")
| SpectraBase Compound ID | CRUG9arDfDi |
|---|---|
| InChI | InChI=1S/C29H47NO3SSi/c1-8-12-22-27(31)29(34(32,30-7)24-18-14-13-15-19-24)26-21-17-16-20-25(26)28(23(5)6)33-35(9-2,10-3)11-4/h8,13-15,18-19,23,25,28H,1,9-12,16-17,20-22H2,2-7H3/b29-26+/t25-,28+,34-/m1/s1 |
| InChIKey | AFYPTLCHMROBBP-SMJVSLJTSA-N |
| Mol Weight | 517.8 g/mol |
| Molecular Formula | C29H47NO3SSi |
| Exact Mass | 517.304592 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | B2XysEyYcvg |
|---|---|
| Name | (E)-1-((R)-2-((S)-2-Methyl-1-(triethylsilyloxy)propyl)cyclohexylidene)-1-[(S)-N-methyl-S-phenyl-sulfonimidoyl)]-hex-5-en-2-one |
| Alternate Name(s) | (E)-1-((R)-2-((S)-2-methyl-1-((triethylsilyl)oxy)propyl)cyclohexylidene)-1-(N-methylphenylsulfonimidoyl)hex-5-en-2-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H47NO3SSi |
| InChI | InChI=1S/C29H47NO3SSi/c1-8-12-22-27(31)29(34(32,30-7)24-18-14-13-15-19-24)26-21-17-16-20-25(26)28(23(5)6)33-35(9-2,10-3)11-4/h8,13-15,18-19,23,25,28H,1,9-12,16-17,20-22H2,2-7H3/b29-26+/t25-,28+,34-/m1/s1 |
| InChIKey | AFYPTLCHMROBBP-SMJVSLJTSA-N |
| Literature Reference DOI | 10.1021/ol800854s |
| Molecular Weight | 517.844 g/mol |
| SMILES | C1C[C@](\C(CC1)=C/(C(CCC=C)=O)[S@@](c1ccccc1)(=O)=NC)([C@](C(C)C)(O[Si](CC)(CC)CC)[H])[H] |
| SPLASH | splash10-0170-0925000000-02cd632a6c7bbe3fd3a7 |
| Source of Spectrum | A1-10-2713/SMS16-8a |
| Wiley ID | 1759570 |