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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 5xDDpeAGRYh
Name 1-Benzylsulfonyl-4-methyl-benzene
CAS Registry Number 5395-20-0
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
Molecular Weight 246.324 g/mol
SMILES c1(S(Cc2ccccc2)(=O)=O)ccc(cc1)C
SPLASH splash10-001l-7910000000-f813e1eaa6e5eb26ef17
Source of Spectrum KC-0-540-7
Synonyms 1-Benzylsulfonyl-4-methylbenzene 1-Methyl-4-(phenylmethyl)sulfonyl-benzene Benzene, 1-methyl-4-[(phenylmethyl)sulfonyl]- 1-Methyl-4-(phenylmethyl)sulfonylbenzene
Wiley ID 820446