![(E)-1-((R)-2-((S)-2-Methyl-1-(triethylsilyloxy)propyl)cyclohexylidene)-1-[(S)-N-methyl-S-phenyl-sulfonimidoyl)]-hept-6-en-2-one](/api/spectrum/EFRhLtBxitG/structure.png?h=300&w=458 "(E)-1-((R)-2-((S)-2-Methyl-1-(triethylsilyloxy)propyl)cyclohexylidene)-1-[(S)-N-methyl-S-phenyl-sulfonimidoyl)]-hept-6-en-2-one")
| SpectraBase Compound ID | C89bJymnzrC |
|---|---|
| InChI | InChI=1S/C30H49NO3SSi/c1-8-12-14-23-28(32)30(35(33,31-7)25-19-15-13-16-20-25)27-22-18-17-21-26(27)29(24(5)6)34-36(9-2,10-3)11-4/h8,13,15-16,19-20,24,26,29H,1,9-12,14,17-18,21-23H2,2-7H3/b30-27+/t26-,29+,35-/m1/s1 |
| InChIKey | IWIFJZFOGITRIY-HYXRNCDBSA-N |
| Mol Weight | 531.9 g/mol |
| Molecular Formula | C30H49NO3SSi |
| Exact Mass | 531.320242 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EFRhLtBxitG |
|---|---|
| Name | (E)-1-((R)-2-((S)-2-Methyl-1-(triethylsilyloxy)propyl)cyclohexylidene)-1-[(S)-N-methyl-S-phenyl-sulfonimidoyl)]-hept-6-en-2-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H49NO3SSi |
| InChI | InChI=1S/C30H49NO3SSi/c1-8-12-14-23-28(32)30(35(33,31-7)25-19-15-13-16-20-25)27-22-18-17-21-26(27)29(24(5)6)34-36(9-2,10-3)11-4/h8,13,15-16,19-20,24,26,29H,1,9-12,14,17-18,21-23H2,2-7H3/b30-27+/t26-,29+,35-/m1/s1 |
| InChIKey | IWIFJZFOGITRIY-HYXRNCDBSA-N |
| Literature Reference DOI | 10.1021/ol800854s |
| Molecular Weight | 531.871 g/mol |
| SMILES | C1C[C@](\C(CC1)=C/(C(CCCC=C)=O)[S@@](=O)(=NC)c1ccccc1)([C@@](O[Si](CC)(CC)CC)(C(C)C)[H])[H] |
| SPLASH | splash10-00ku-3912000000-63e77b528a1cf8b5d33f |
| Source of Spectrum | A1-10-2713/SMS17-8b |
| Synonyms | (E)-1-((R)-2-((S)-2-methyl-1-((triethylsilyl)oxy)propyl)cyclohexylidene)-1-(N-methylphenylsulfonimidoyl)hept-6-en-2-one |
| Wiley ID | 1759571 |