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(3R,5R)-6-(1,3-dithian-2-yl)-4,4-dimethyl-hexane-1,3,5-triol

View entire compound with spectra: 2 MS (GC)

(3R,5R)-6-(1,3-dithian-2-yl)-4,4-dimethyl-hexane-1,3,5-triol
SpectraBase Compound ID AxURvr4iOnw
InChI InChI=1S/C12H24O3S2/c1-12(2,9(14)4-5-13)10(15)8-11-16-6-3-7-17-11/h9-11,13-15H,3-8H2,1-2H3/t9-,10-/m1/s1
InChIKey LPFPNYDEVZYONR-NXEZZACHSA-N
Mol Weight 280.44 g/mol
Molecular Formula C12H24O3S2
Exact Mass 280.116687 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 11dBZrbgtQg
Name (3R,5R)-6-(1,3-dithian-2-yl)-4,4-dimethyl-hexane-1,3,5-triol
Alternate Name(s) (3R,5R)-6-(1,3-Dithian-2-yl)-4,4-dimethylhexane-1,3,5-triol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H24O3S2
InChI InChI=1S/C12H24O3S2/c1-12(2,9(14)4-5-13)10(15)8-11-16-6-3-7-17-11/h9-11,13-15H,3-8H2,1-2H3/t9-,10-/m1/s1
InChIKey LPFPNYDEVZYONR-NXEZZACHSA-N
Molecular Weight 280.441 g/mol
SMILES O[C@@](C([C@@](CCO)(O)[H])(C)C)(CC1SCCCS1)[H]
SPLASH splash10-00ls-9810000000-cf01564f4e435326e7fe
Source of Spectrum K1-2002-1542-11
Wiley ID 1522429