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(2R,3S)-5-Benzenesulfonyl-2-butyl-6-methyl-3,4-dihydro-2H-pyran-3-ol
SpectraBase Compound ID 8zIGfbOgK8P
InChI InChI=1S/C16H22O4S/c1-3-4-10-15-14(17)11-16(12(2)20-15)21(18,19)13-8-6-5-7-9-13/h5-9,14-15,17H,3-4,10-11H2,1-2H3/t14-,15+/m0/s1
InChIKey AJAQQMMEXGFTGH-LSDHHAIUSA-N
Mol Weight 310.41 g/mol
Molecular Formula C16H22O4S
Exact Mass 310.12388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BeZJGWD1B9o
Name (2R,3S)-5-Benzenesulfonyl-2-butyl-6-methyl-3,4-dihydro-2H-pyran-3-ol
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O4S
InChI InChI=1S/C16H22O4S/c1-3-4-10-15-14(17)11-16(12(2)20-15)21(18,19)13-8-6-5-7-9-13/h5-9,14-15,17H,3-4,10-11H2,1-2H3/t14-,15+/m0/s1
InChIKey AJAQQMMEXGFTGH-LSDHHAIUSA-N
Molecular Weight 310.408 g/mol
SMILES O[C@]1(CC(S(=O)(=O)c2ccccc2)=C(O[C@@]1(CCCC)[H])C)[H]
SPLASH splash10-0006-9001000000-36e6b0ea8f9e91bb30b5
Source of Spectrum C-126-9656-9g
Synonyms (trans)-2-Butyl-3-hydroxy-5-(phenylsulfonyl)-6-methyl-3,4-dihydro-2H-pyran
Wiley ID 1701341