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6,6-Bis-benzenesulfonyl-4-methyl-hexan-3-one
SpectraBase Compound ID Bple00dV3gf
InChI InChI=1S/C19H22O5S2/c1-3-18(20)15(2)14-19(25(21,22)16-10-6-4-7-11-16)26(23,24)17-12-8-5-9-13-17/h4-13,15,19H,3,14H2,1-2H3
InChIKey FOPUOIGGRATJDZ-UHFFFAOYSA-N
Mol Weight 394.5 g/mol
Molecular Formula C19H22O5S2
Exact Mass 394.090866 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DYzg2BS8VJE
Name 6,6-Bis-benzenesulfonyl-4-methyl-hexan-3-one
Alternate Name(s) 4-Methyl-6,6-bis(phenylsulfonyl)-3-hexanone 4-Methyl-6,6-bis(phenylsulfonyl)hexan-3-one 6,6-bis(benzenesulfonyl)-4-methyl-3-hexanone 6,6-Dibesyl-4-methyl-hexan-3-one 6,6-bis(benzenesulfonyl)-4-methylhexan-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22O5S2
InChI InChI=1S/C19H22O5S2/c1-3-18(20)15(2)14-19(25(21,22)16-10-6-4-7-11-16)26(23,24)17-12-8-5-9-13-17/h4-13,15,19H,3,14H2,1-2H3
InChIKey FOPUOIGGRATJDZ-UHFFFAOYSA-N
Molecular Weight 394.500 g/mol
SMILES C(=O)(CC)C(C)CC(S(=O)(=O)c1ccccc1)S(=O)(c1ccccc1)=O
SPLASH splash10-056r-9812000000-d94f4a336b78149d33bc
Wiley ID 1487652