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(2S,3R,6S)-2-Benzyloxy-3-ethyl-7-toluenesulfonyloxyheptan-2,6-diol
SpectraBase Compound ID 7JMmUolB3Re
InChI InChI=1S/C23H32O6S/c1-4-20(23(3,25)28-16-19-8-6-5-7-9-19)12-13-21(24)17-29-30(26,27)22-14-10-18(2)11-15-22/h5-11,14-15,20-21,24-25H,4,12-13,16-17H2,1-3H3/t20-,21+,23+/m1/s1
InChIKey LSYYWGTVTQRQMX-GIWBLDEGSA-N
Mol Weight 436.6 g/mol
Molecular Formula C23H32O6S
Exact Mass 436.19196 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 45AMPRrSNtU
Name (2S,3R,6S)-2-Benzyloxy-3-ethyl-7-toluenesulfonyloxyheptan-2,6-diol
Alternate Name(s) (2S,5R,6S)-6-(benzyloxy)-5-ethyl-2,6-dihydroxyheptyl 4-methylbenzenesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H32O6S
InChI InChI=1S/C23H32O6S/c1-4-20(23(3,25)28-16-19-8-6-5-7-9-19)12-13-21(24)17-29-30(26,27)22-14-10-18(2)11-15-22/h5-11,14-15,20-21,24-25H,4,12-13,16-17H2,1-3H3/t20-,21+,23+/m1/s1
InChIKey LSYYWGTVTQRQMX-GIWBLDEGSA-N
Molecular Weight 436.563 g/mol
SMILES O[C@]([C@@](CC[C@@](COS(c1ccc(cc1)C)(=O)=O)(O)[H])(CC)[H])(OCc1ccccc1)C
SPLASH splash10-0006-9311000000-41eba50149d156edd84c
Source of Spectrum E1-37-1714-41
Wiley ID 1517862