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1-Isopropoxy-3-(phenylsulfanyl)propan-2-ol
SpectraBase Compound ID 29Uwn88SuNe
InChI InChI=1S/C12H18O2S/c1-10(2)14-8-11(13)9-15-12-6-4-3-5-7-12/h3-7,10-11,13H,8-9H2,1-2H3
InChIKey ACMGDXBHUYIAKY-UHFFFAOYSA-N
Mol Weight 226.33 g/mol
Molecular Formula C12H18O2S
Exact Mass 226.102751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IFLLhjQGso5
Name 1-Isopropoxy-3-(phenylsulfanyl)propan-2-ol
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O2S
InChI InChI=1S/C12H18O2S/c1-10(2)14-8-11(13)9-15-12-6-4-3-5-7-12/h3-7,10-11,13H,8-9H2,1-2H3
InChIKey ACMGDXBHUYIAKY-UHFFFAOYSA-N
Instrument Name Fisons 8000
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0006.f10
Molecular Weight 226.334 g/mol
SMILES OC(COC(C)C)CSc1ccccc1
SPLASH splash10-0a4i-2910000000-06a8ae948b91d29565ce
Source of Spectrum ARK-2005-71-3ca
Thin-Layer Chromatography Rf = 0.59 (EtOAc/hexane, 2:8)
Wiley ID 1870978