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(+)-(3R,4S,5R,6R)-3,6-Dihydroxy-4,5-O-isopropylidenethiepane
SpectraBase Compound ID HkGVISYIILP
InChI InChI=1S/C9H16O4S/c1-9(2)12-7-5(10)3-14-4-6(11)8(7)13-9/h5-8,10-11H,3-4H2,1-2H3/t5-,6-,7-,8+/m0/s1
InChIKey AMTZCFFTUVSCSK-DKXJUACHSA-N
Mol Weight 220.28 g/mol
Molecular Formula C9H16O4S
Exact Mass 220.07693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HnbrC13eSJw
Name (+)-(3R,4S,5R,6R)-3,6-Dihydroxy-4,5-O-isopropylidenethiepane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O4S
InChI InChI=1S/C9H16O4S/c1-9(2)12-7-5(10)3-14-4-6(11)8(7)13-9/h5-8,10-11H,3-4H2,1-2H3/t5-,6-,7-,8+/m0/s1
InChIKey AMTZCFFTUVSCSK-DKXJUACHSA-N
Molecular Weight 220.283 g/mol
SMILES O[C@@]1([C@]2([C@@]([C@](CSC1)(O)[H])(OC(O2)(C)C)[H])[H])[H]
SPLASH splash10-0pb9-9440000000-e95efb654d9627ab7802
Source of Spectrum F-70-668-3
Wiley ID 1596171