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(2R,5R,6S)-5,6-Diisopropyl-2-(pent-4-enyl)-3-[(S)-N-methyl-S-phenyl-sulfonimidoyl)]-5,6-dihydro-2H-pyran-2-ol
SpectraBase Compound ID 1nEtyE5XLNR
InChI InChI=1S/C23H35NO3S/c1-7-8-12-15-23(25)21(16-20(17(2)3)22(27-23)18(4)5)28(26,24-6)19-13-10-9-11-14-19/h7,9-11,13-14,16-18,20,22,25H,1,8,12,15H2,2-6H3/t20-,22-,23+,28+/m0/s1
InChIKey XQHWVVXMAOIYKM-IYLRLLGOSA-N
Mol Weight 405.6 g/mol
Molecular Formula C23H35NO3S
Exact Mass 405.233765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6nPJZjBIdTx
Name (2R,5R,6S)-5,6-Diisopropyl-2-(pent-4-enyl)-3-[(S)-N-methyl-S-phenyl-sulfonimidoyl)]-5,6-dihydro-2H-pyran-2-ol
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Formula C23H35NO3S
InChI InChI=1S/C23H35NO3S/c1-7-8-12-15-23(25)21(16-20(17(2)3)22(27-23)18(4)5)28(26,24-6)19-13-10-9-11-14-19/h7,9-11,13-14,16-18,20,22,25H,1,8,12,15H2,2-6H3/t20-,22-,23+,28+/m0/s1
InChIKey XQHWVVXMAOIYKM-IYLRLLGOSA-N
Literature Reference DOI 10.1021/ol800854s
Molecular Weight 405.597 g/mol
SMILES O[C@]1(CCCC=C)O[C@]([C@](C(C)C)(C=C1[S@](c1ccccc1)(=NC)=O)[H])(C(C)C)[H]
SPLASH splash10-059g-1519000000-2c61498f12570d2947bc
Source of Spectrum A1-10-2713/SMS18-9b
Synonyms (2R,5R,6S)-5,6-Diisopropyl-2-(pent-4-enyl)-3-[(R)-N-methyl-S-phenyl-sulfonimidoyl]-5,6-dihydro-2H-pyran-2-ol (2R,5R,6S)-5,6-diisopropyl-3-(N-methylphenylsulfonimidoyl)-2-(pent-4-en-1-yl)-5,6-dihydro-2H-pyran-2-ol (2R,5R,6S)-5,6-Diisopropyl-2-(pent-4-enyl)-3-[(R)-N-methyl-Sphenyl-sulfonimidoyl]-5,6-dihydro-2H-pyran-2-ol (2R,5R,6S)-5,6-diisopropyl-3-((R)-N-methylphenylsulfonimidoyl)-2-(pent-4-en-1-yl)-5,6-dihydro-2H-pyran-2-ol
Wiley ID 1759572