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(2S,3R)-2-tert-Butylthio-1-phenylhexan-3-ol
SpectraBase Compound ID LCnEG8BZxCM
InChI InChI=1S/C16H26OS/c1-5-9-14(17)15(18-16(2,3)4)12-13-10-7-6-8-11-13/h6-8,10-11,14-15,17H,5,9,12H2,1-4H3/t14-,15+/m1/s1
InChIKey UINRQGFLLJCEEF-CABCVRRESA-N
Mol Weight 266.44 g/mol
Molecular Formula C16H26OS
Exact Mass 266.170437 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IrwGkilIuOp
Name (2S,3R)-2-tert-Butylthio-1-phenylhexan-3-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H26OS
InChI InChI=1S/C16H26OS/c1-5-9-14(17)15(18-16(2,3)4)12-13-10-7-6-8-11-13/h6-8,10-11,14-15,17H,5,9,12H2,1-4H3/t14-,15+/m1/s1
InChIKey UINRQGFLLJCEEF-CABCVRRESA-N
Molecular Weight 266.443 g/mol
SMILES O[C@@]([C@@](SC(C)(C)C)(Cc1ccccc1)[H])(CCC)[H]
SPLASH splash10-05n0-5900000000-d16a711107e78c4997d9
Source of Spectrum F-52-2902-2
Synonyms (2S,3R)-2-(tert-butylsulfanyl)-1-phenyl-3-hexanol
Wiley ID 795454