2-[(2S,3S,4R)-2,4-Dihydroxy-3,5-dimethylhexyl]-1,3-dithiane

SpectraBase Compound ID	zlI0nnhmR2
InChI	InChI=1S/C12H24O2S2/c1-8(2)12(14)9(3)10(13)7-11-15-5-4-6-16-11/h8-14H,4-7H2,1-3H3/t9-,10-,12+/m0/s1
InChIKey	UMGUDJFMZDNFMM-JBLDHEPKSA-N Google Search
Mol Weight	264.44 g/mol
Molecular Formula	C12H24O2S2
Exact Mass	264.121772 g/mol

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SpectraBase Spectrum ID	JiFgoVrjeZP
Name	2-[(2S,3S,4R)-2,4-Dihydroxy-3,5-dimethylhexyl]-1,3-dithiane
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C12H24O2S2
InChI	InChI=1S/C12H24O2S2/c1-8(2)12(14)9(3)10(13)7-11-15-5-4-6-16-11/h8-14H,4-7H2,1-3H3/t9-,10-,12+/m0/s1
InChIKey	UMGUDJFMZDNFMM-JBLDHEPKSA-N
Molecular Weight	264.442 g/mol
SMILES	O[C@]([C@@]([C@@](C(C)C)(O)[H])(C)[H])(CC1SCCCS1)[H]
SPLASH	splash10-0002-0090000000-bd648602506c875357a3
Source of Spectrum	F-53-9385-22
Synonyms	(2S,3S,4R)-1-(1,3-dithian-2-yl)-3,5-dimethyl-2,4-hexanediol
Wiley ID	802900