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(3S,4S,5S)-4-ETHYNYL-2-METHYL-5-[N-(4-METHYLPHENYLSULFONYL)-AMINO]-HEXAN-3-OL
SpectraBase Compound ID 1KIaPPjdLph
InChI InChI=1S/C16H23NO3S/c1-6-15(16(18)11(2)3)13(5)17-21(19,20)14-9-7-12(4)8-10-14/h1,7-11,13,15-18H,2-5H3/t13-,15+,16+/m1/s1
InChIKey JSJSGEBZQSUMLQ-KBMXLJTQSA-N
Mol Weight 309.42 g/mol
Molecular Formula C16H23NO3S
Exact Mass 309.139865 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GoE63ooqvlx
Name (3S,4S,5S)-4-ETHYNYL-2-METHYL-5-[N-(4-METHYLPHENYLSULFONYL)-AMINO]-HEXAN-3-OL
Compound Number 21
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H23NO3S
InChI InChI=1S/C16H23NO3S/c1-6-15(16(18)11(2)3)13(5)17-21(19,20)14-9-7-12(4)8-10-14/h1,7-11,13,15-18H,2-5H3/t13-,15+,16+/m1/s1
InChIKey JSJSGEBZQSUMLQ-KBMXLJTQSA-N
Literature Reference Author H.OHNO,H.HAMAGUCHI,T.TANAKA
Literature Reference Citation J.ORG.CHEM.,66,1867(2001)
Literature Reference DOI 10.1021/jo005756v
Molecular Weight 309.424 g/mol
Solvent CDCl3
Source File Reference UWMS26234