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1-(4-Methylphenyl)sulfonyl-3-phenyl-2-propanone
SpectraBase Compound ID 2LlHMi6UheT
InChI InChI=1S/C16H16O3S/c1-13-7-9-16(10-8-13)20(18,19)12-15(17)11-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3
InChIKey VAHGDNXCPGLYKG-UHFFFAOYSA-N
Mol Weight 288.36 g/mol
Molecular Formula C16H16O3S
Exact Mass 288.082016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CTXpgh1McjH
Name 1-(4-Methylphenyl)sulfonyl-3-phenyl-2-propanone
Alternate Name(s) 1-(4-Methylphenyl)sulfonyl-3-phenyl-propan-2-one 1-Phenyl-3-(p-tolylsulfonyl)propan-2-one 1-Phenyl-3-tosyl-acetone
CAS Registry Number 66947-21-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16O3S
InChI InChI=1S/C16H16O3S/c1-13-7-9-16(10-8-13)20(18,19)12-15(17)11-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3
InChIKey VAHGDNXCPGLYKG-UHFFFAOYSA-N
Molecular Weight 288.361 g/mol
SMILES C(S(c1ccc(cc1)C)(=O)=O)C(=O)Cc1ccccc1
SPLASH splash10-000x-9510000000-d9d0011b938092680688
Source of Spectrum F-46-4000-10
Wiley ID 1291641