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benzyl p-tolyl sulfone
SpectraBase Compound ID KuniTqjuwVa
InChI InChI=1S/C14H14O2S/c1-12-7-9-14(10-8-12)17(15,16)11-13-5-3-2-4-6-13/h2-10H,11H2,1H3
InChIKey OHCLHQCVALHTDN-UHFFFAOYSA-N
Mol Weight 246.32 g/mol
Molecular Formula C14H14O2S
Exact Mass 246.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JmUhjqeqU6N
Name 1-(benzylsulfonyl)-4-methylbenzene
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14O2S
InChI InChI=1S/C14H14O2S/c1-12-7-9-14(10-8-12)17(15,16)11-13-5-3-2-4-6-13/h2-10H,11H2,1H3
InChIKey OHCLHQCVALHTDN-UHFFFAOYSA-N
Instrument Name Agilent Technologies GC/MS-5973N
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202000425
Molecular Weight 246.324 g/mol
SMILES C(S(c1ccc(cc1)C)(=O)=O)c1ccccc1
SPLASH splash10-0006-9000000000-9aa305be2139e8b13cd9
Source of Spectrum U1-2020-SM5-4i
Thin-Layer Chromatography Rf = 0.43 (hexane/ethyl acetate, 7:3)
Wiley ID 1860649