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Methyl p-butylbenzyl sulfone
SpectraBase Compound ID 2B4VWIlsPzB
InChI InChI=1S/C12H18O2S/c1-3-4-5-11-6-8-12(9-7-11)10-15(2,13)14/h6-9H,3-5,10H2,1-2H3
InChIKey MHOMVAIAWJAOJN-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 DiUQSCVHX6K
Name Methyl p-butylbenzyl sulfone
Alternate Name(s) 1-Butyl-4-[(methylsulfonyl)methyl]benzene 4-Butylbenzyl methyl sulfone
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Formula C12H18O2S
InChI InChI=1S/C12H18O2S/c1-3-4-5-11-6-8-12(9-7-11)10-15(2,13)14/h6-9H,3-5,10H2,1-2H3
InChIKey MHOMVAIAWJAOJN-UHFFFAOYSA-N
Molecular Weight 226.334 g/mol
SMILES C(S(=O)(=O)C)c1ccc(cc1)CCCC
SPLASH splash10-0002-1900000000-7904cb1e1b440998c211
Source of Spectrum QC-5-1246-4
Wiley ID 883667