2-[(2S,4S)-2,4-dimethyloctyl]-2-[[(3R,4R)-4-phenylmethoxy-3-thiolanyl]methyl]-1,3-dithiane

SpectraBase Compound ID	eASD6Mnrz1
InChI	InChI=1S/C26H42OS3/c1-4-5-10-21(2)15-22(3)16-26(29-13-9-14-30-26)17-24-19-28-20-25(24)27-18-23-11-7-6-8-12-23/h6-8,11-12,21-22,24-25H,4-5,9-10,13-20H2,1-3H3/t21-,22-,24-,25-/m0/s1
InChIKey	OEYOKKKWSLFEIW-TWVZQSRDSA-N Google Search
Mol Weight	466.8 g/mol
Molecular Formula	C26H42OS3
Exact Mass	466.239779 g/mol

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SpectraBase Spectrum ID	3MNtaJt0weR
Name	2-[(2S,4S)-2,4-dimethyloctyl]-2-[[(3R,4R)-4-phenylmethoxy-3-thiolanyl]methyl]-1,3-dithiane
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C26H42OS3
InChI	InChI=1S/C26H42OS3/c1-4-5-10-21(2)15-22(3)16-26(29-13-9-14-30-26)17-24-19-28-20-25(24)27-18-23-11-7-6-8-12-23/h6-8,11-12,21-22,24-25H,4-5,9-10,13-20H2,1-3H3/t21-,22-,24-,25-/m0/s1
InChIKey	OEYOKKKWSLFEIW-TWVZQSRDSA-N
Molecular Weight	466.801 g/mol
SMILES	C1(SCCCS1)(C[C@@]1([C@@](OCc2ccccc2)(CSC1)[H])[H])C[C@](C[C@](CCCC)(C)[H])(C)[H]
SPLASH	splash10-052f-9061100000-a9b74f26f337557af80b
Source of Spectrum	SO-0-1866-8
Synonyms	2-[(2S,4S)-2,4-dimethyloctyl]-2-[[(3R,4R)-4-phenylmethoxythiolan-3-yl]methyl]-1,3-dithiane 2-[[(3R,4R)-4-benzoxytetrahydrothiophen-3-yl]methyl]-2-[(2S,4S)-2,4-dimethyloctyl]-1,3-dithiane 2-[[(3R,4R)-4-benzyloxytetrahydrothiophen-3-yl]methyl]-2-[(2S,4S)-2,4-dimethyloctyl]-1,3-dithiane
Wiley ID	878226