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2-Butanol, 3-methyl-1,1-bis(phenylthio)-
SpectraBase Compound ID 4IMik2D0OhG
InChI InChI=1S/C17H20OS2/c1-13(2)16(18)17(19-14-9-5-3-6-10-14)20-15-11-7-4-8-12-15/h3-13,16-18H,1-2H3
InChIKey AYJQYUKDZKROKW-UHFFFAOYSA-N
Mol Weight 304.47 g/mol
Molecular Formula C17H20OS2
Exact Mass 304.095558 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2XeS5MRd68
Name 2-Butanol, 3-methyl-1,1-bis(phenylthio)-
CAS Registry Number 71221-31-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20OS2
InChI InChI=1S/C17H20OS2/c1-13(2)16(18)17(19-14-9-5-3-6-10-14)20-15-11-7-4-8-12-15/h3-13,16-18H,1-2H3
InChIKey AYJQYUKDZKROKW-UHFFFAOYSA-N
Molecular Weight 304.466 g/mol
SMILES OC(C(Sc1ccccc1)Sc1ccccc1)C(C)C
SPLASH splash10-022c-0900000000-d600b8b3194296ddbfb9
Source of Spectrum KC-1979-1081-0
Synonyms 3-Methyl-1,1-bis(phenylsulfanyl)-2-butanol 3-Methyl-1,1-bis(phenylthio)butan-2-ol
Wiley ID 1306423