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(2R,3R)-2-ethynyl-1-(4-methylphenyl)sulfonyl-piperidin-3-ol
SpectraBase Compound ID il81YY5yDD
InChI InChI=1S/C14H17NO3S/c1-3-13-14(16)5-4-10-15(13)19(17,18)12-8-6-11(2)7-9-12/h1,6-9,13-14,16H,4-5,10H2,2H3/t13-,14-/m1/s1
InChIKey LLDMTWKKFHKSMP-ZIAGYGMSSA-N
Mol Weight 279.35 g/mol
Molecular Formula C14H17NO3S
Exact Mass 279.092915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HvB8lXiz17Y
Name (2R,3R)-2-ethynyl-1-(4-methylphenyl)sulfonyl-piperidin-3-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17NO3S
InChI InChI=1S/C14H17NO3S/c1-3-13-14(16)5-4-10-15(13)19(17,18)12-8-6-11(2)7-9-12/h1,6-9,13-14,16H,4-5,10H2,2H3/t13-,14-/m1/s1
InChIKey LLDMTWKKFHKSMP-ZIAGYGMSSA-N
Molecular Weight 279.354 g/mol
SMILES O[C@]1([C@](N(S(c2ccc(cc2)C)(=O)=O)CCC1)(C#C)[H])[H]
SPLASH splash10-00dl-5900000000-8d605092fa576f9a39ad
Source of Spectrum J-63-6285-0
Synonyms (2R,3R)-2-ethynyl-1-(p-tolylsulfonyl)piperidin-3-ol (2R,3R)-2-ethynyl-1-tosyl-piperidin-3-ol (2R,3R)-2-ethynyl-1-(4-methylphenyl)sulfonyl-3-piperidinol
Wiley ID 1282851