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(2R,3R,4R,5S)-3,5-Dimethyl-2-hydroxy-4,6-isopropylidenedioxyhexanal trimethylene dithioacetal
SpectraBase Compound ID I2K4hqIOTdU
InChI InChI=1S/C14H26O3S2/c1-9-8-16-14(3,4)17-12(9)10(2)11(15)13-18-6-5-7-19-13/h9-13,15H,5-8H2,1-4H3/t9-,10+,11+,12+/m0/s1
InChIKey TUTFUOLKJUGXKK-IRCOFANPSA-N
Mol Weight 306.48 g/mol
Molecular Formula C14H26O3S2
Exact Mass 306.132337 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4FjTyOyBSi
Name (2R,3R,4R,5S)-3,5-Dimethyl-2-hydroxy-4,6-isopropylidenedioxyhexanal trimethylene dithioacetal
Alternate Name(s) (1R,2R)-1-(1,3-dithian-2-yl)-2-[(4R,5S)-2,2,5-trimethyl-1,3-dioxan-4-yl]propan-1-ol (2R,3S,4S,5S)-3,5-Dimethyl-2-hydroxy-4,6-isopropylidenedioxyhexanal trimethylene dithioacetal
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Formula C14H26O3S2
InChI InChI=1S/C14H26O3S2/c1-9-8-16-14(3,4)17-12(9)10(2)11(15)13-18-6-5-7-19-13/h9-13,15H,5-8H2,1-4H3/t9-,10+,11+,12+/m0/s1
InChIKey TUTFUOLKJUGXKK-IRCOFANPSA-N
Molecular Weight 306.479 g/mol
SMILES O[C@]([C@]([C@@]1(OC(C)(C)OC[C@@]1(C)[H])[H])(C)[H])(C1SCCCS1)[H]
SPLASH splash10-016r-0900000000-4f47224140802544852d
Source of Spectrum E1-37-1170-17
Wiley ID 1517691