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(4R,5R,6S)-5-Methyl-7-phenylsulfonyl-1-heptene-4,6-diol
SpectraBase Compound ID 4hSdRRoZLSA
InChI InChI=1S/C14H20O4S/c1-3-7-13(15)11(2)14(16)10-19(17,18)12-8-5-4-6-9-12/h3-6,8-9,11,13-16H,1,7,10H2,2H3/t11-,13-,14-/m1/s1
InChIKey CEQIKVJUNALBTR-MRVWCRGKSA-N
Mol Weight 284.37 g/mol
Molecular Formula C14H20O4S
Exact Mass 284.10823 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6H82XwmFGQe
Name (4R,5R,6S)-5-Methyl-7-phenylsulfonyl-1-heptene-4,6-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O4S
InChI InChI=1S/C14H20O4S/c1-3-7-13(15)11(2)14(16)10-19(17,18)12-8-5-4-6-9-12/h3-6,8-9,11,13-16H,1,7,10H2,2H3/t11-,13-,14-/m1/s1
InChIKey CEQIKVJUNALBTR-MRVWCRGKSA-N
Molecular Weight 284.370 g/mol
SMILES O[C@@]([C@]([C@@](CS(=O)(=O)c1ccccc1)(O)[H])(C)[H])(CC=C)[H]
SPLASH splash10-004i-9330000000-dcd8356dce48f8eae57d
Source of Spectrum F-52-8305-0
Synonyms (2S,3R,4R)-3-methyl-1-(phenylsulfonyl)-6-heptene-2,4-diol
Wiley ID 797185