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p-Tolyl o-methylbenzyl-.alpha.-2-propyl sulfone
SpectraBase Compound ID DBmWdCIZGYn
InChI InChI=1S/C18H22O2S/c1-13(2)18(17-8-6-5-7-15(17)4)21(19,20)16-11-9-14(3)10-12-16/h5-13,18H,1-4H3
InChIKey KHRGVCIKFJHTGO-UHFFFAOYSA-N
Mol Weight 302.43 g/mol
Molecular Formula C18H22O2S
Exact Mass 302.134051 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DpO4FnYvL4t
Name p-Tolyl o-methylbenzyl-.alpha.-2-propyl sulfone
Alternate Name(s) 1-Methyl-2-{2-methyl-1-[(4-methylphenyl)sulfonyl]propyl}benzene 2-Methyl-1-(2-methylphenyl)propyl 4-methylphenyl sulfone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22O2S
InChI InChI=1S/C18H22O2S/c1-13(2)18(17-8-6-5-7-15(17)4)21(19,20)16-11-9-14(3)10-12-16/h5-13,18H,1-4H3
InChIKey KHRGVCIKFJHTGO-UHFFFAOYSA-N
Molecular Weight 302.432 g/mol
SMILES C(S(c1ccc(cc1)C)(=O)=O)(c1c(C)cccc1)C(C)C
SPLASH splash10-0a4i-1900000000-ceef3e66457cff1aaa2d
Source of Spectrum J-63-2082-27
Wiley ID 1304781