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1,3-Dithiane-2-methanol, .alpha.-(2-methylpropyl)-2-(phenylmethyl)-
SpectraBase Compound ID C0vBJ222EP1
InChI InChI=1S/C16H24OS2/c1-13(2)11-15(17)16(18-9-6-10-19-16)12-14-7-4-3-5-8-14/h3-5,7-8,13,15,17H,6,9-12H2,1-2H3
InChIKey XOPMDMQJLNTDHL-UHFFFAOYSA-N
Mol Weight 296.49 g/mol
Molecular Formula C16H24OS2
Exact Mass 296.126858 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2oaRSYCye6H
Name 1,3-Dithiane-2-methanol, .alpha.-(2-methylpropyl)-2-(phenylmethyl)-
Alternate Name(s) 1-(2-benzyl-1,3-dithian-2-yl)-3-methyl-1-butanol 5-Methyl-1-phenyl-2,2-trimethylenedithio-3-hexanol
CAS Registry Number 70067-96-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H24OS2
InChI InChI=1S/C16H24OS2/c1-13(2)11-15(17)16(18-9-6-10-19-16)12-14-7-4-3-5-8-14/h3-5,7-8,13,15,17H,6,9-12H2,1-2H3
InChIKey XOPMDMQJLNTDHL-UHFFFAOYSA-N
Molecular Weight 296.487 g/mol
SMILES OC(C1(SCCCS1)Cc1ccccc1)CC(C)C
SPLASH splash10-0a4i-3290000000-d7cd22bf6606bc1ce801
Source of Spectrum H-61-3093-0
Wiley ID 1298996