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(2RS,3RS)-3-Methyl-2,4,4-tris(phenylthio)hexan-1-ol
SpectraBase Compound ID 8o9tTpfpNya
InChI InChI=1S/C25H28OS3/c1-3-25(28-22-15-9-5-10-16-22,29-23-17-11-6-12-18-23)20(2)24(19-26)27-21-13-7-4-8-14-21/h4-18,20,24,26H,3,19H2,1-2H3
InChIKey GHWWBQPEWLJAQT-UHFFFAOYSA-N
Mol Weight 440.68 g/mol
Molecular Formula C25H28OS3
Exact Mass 440.130229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2XWOVlQXQzO
Name (2RS,3RS)-3-Methyl-2,4,4-tris(phenylthio)hexan-1-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H28OS3
InChI InChI=1S/C25H28OS3/c1-3-25(28-22-15-9-5-10-16-22,29-23-17-11-6-12-18-23)20(2)24(19-26)27-21-13-7-4-8-14-21/h4-18,20,24,26H,3,19H2,1-2H3
InChIKey GHWWBQPEWLJAQT-UHFFFAOYSA-N
Molecular Weight 440.678 g/mol
SMILES OCC(C(C(Sc1ccccc1)(Sc1ccccc1)CC)C)Sc1ccccc1
SPLASH splash10-03di-0900000000-22a1b9787f285511f88e
Source of Spectrum KC-0-2963-27
Synonyms 3-Methyl-2,4,4-tris(phenylsulfanyl)-1-hexanol
Wiley ID 782371