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4-Tosyl-2,5-octanodione

View entire compound with spectra: 1 MS (GC)

4-Tosyl-2,5-octanodione
SpectraBase Compound ID 6WlIxsI5ns3
InChI InChI=1S/C15H20O4S/c1-4-5-14(17)15(10-12(3)16)20(18,19)13-8-6-11(2)7-9-13/h6-9,15H,4-5,10H2,1-3H3
InChIKey CGSPWQILDCKNRG-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 I4w14UNtMN7
Name 4-Tosyl-2,5-octanodione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O4S
InChI InChI=1S/C15H20O4S/c1-4-5-14(17)15(10-12(3)16)20(18,19)13-8-6-11(2)7-9-13/h6-9,15H,4-5,10H2,1-3H3
InChIKey CGSPWQILDCKNRG-UHFFFAOYSA-N
Molecular Weight 296.381 g/mol
SMILES C(S(c1ccc(cc1)C)(=O)=O)(CC(=O)C)C(=O)CCC
SPLASH splash10-006x-9100000000-271ed8b69947a40dcdcf
Source of Spectrum F-51-2771-10
Synonyms 4-[(4-methylphenyl)sulfonyl]-2,5-octanedione
Wiley ID 791413