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3-HYDROXY-4-METHYL-4-PHENYLSULFANYL-1-SULFANYLPENTANE

View entire compound with spectra: 1 NMR, and 1 MS (GC)

3-HYDROXY-4-METHYL-4-PHENYLSULFANYL-1-SULFANYLPENTANE
SpectraBase Compound ID DboaxhLfU1x
InChI InChI=1S/C12H18OS2/c1-12(2,11(13)8-9-14)15-10-6-4-3-5-7-10/h3-7,11,13-14H,8-9H2,1-2H3
InChIKey KZMATPFAOLIKMY-UHFFFAOYSA-N
Mol Weight 242.39 g/mol
Molecular Formula C12H18OS2
Exact Mass 242.079908 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2wWUm2RCh5a
Name 1-Mercapto-4-methyl-4-(phenylthio)-3-pentanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18OS2
InChI InChI=1S/C12H18OS2/c1-12(2,11(13)8-9-14)15-10-6-4-3-5-7-10/h3-7,11,13-14H,8-9H2,1-2H3
InChIKey KZMATPFAOLIKMY-UHFFFAOYSA-N
Molecular Weight 242.395 g/mol
SMILES SCCC(C(Sc1ccccc1)(C)C)O
SPLASH splash10-0udi-0920000000-3b1740ba48ce19c63a8b
Source of Spectrum KC-0-2786-10
Synonyms 1-Mercapto-4-methyl-4-(phenylthio)pentan-3-ol 4-Methyl-4-phenylsulfanyl-1-sulfanyl-pentan-3-ol
Wiley ID 829068