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6-Methyl-4-tosyl-2,5-heptanedione
SpectraBase Compound ID 1EJgHLGTMNg
InChI InChI=1S/C15H20O4S/c1-10(2)15(17)14(9-12(4)16)20(18,19)13-7-5-11(3)6-8-13/h5-8,10,14H,9H2,1-4H3
InChIKey SDLVBHAVTFAMIC-UHFFFAOYSA-N
Mol Weight 296.38 g/mol
Molecular Formula C15H20O4S
Exact Mass 296.10823 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2theezxU0G
Name 6-Methyl-4-tosyl-2,5-heptanedione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O4S
InChI InChI=1S/C15H20O4S/c1-10(2)15(17)14(9-12(4)16)20(18,19)13-7-5-11(3)6-8-13/h5-8,10,14H,9H2,1-4H3
InChIKey SDLVBHAVTFAMIC-UHFFFAOYSA-N
Molecular Weight 296.381 g/mol
SMILES C(S(c1ccc(cc1)C)(=O)=O)(C(=O)C(C)C)CC(=O)C
SPLASH splash10-0006-9330000000-f6ee0e3e0a1a70095ebc
Source of Spectrum F-51-2771-10
Synonyms 6-Methyl-4-[(4-methylphenyl)sulfonyl]-2,5-heptanedione
Wiley ID 791412