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2,5-DIHYDRO-4-(p-TOLYLTHIO)-3-THIENYL METHYL KETONE, 1,1-DIOXIDE

View entire compound with spectra: 1 NMR, and 1 FTIR

2,5-DIHYDRO-4-(p-TOLYLTHIO)-3-THIENYL METHYL KETONE, 1,1-DIOXIDE
SpectraBase Compound ID KeHmEcvD0Y3
InChI InChI=1S/C13H14O3S2/c1-9-3-5-11(6-4-9)17-13-8-18(15,16)7-12(13)10(2)14/h3-6H,7-8H2,1-2H3
InChIKey ARFMFZICAMXCCI-UHFFFAOYSA-N
Mol Weight 282.37 g/mol
Molecular Formula C13H14O3S2
Exact Mass 282.038437 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 35fI1KnHlDh
Name 2,5-DIHYDRO-4-(p-TOLYLTHIO)-3-THIENYL METHYL KETONE, 1,1-DIOXIDE
Source of Sample Bionet Research Ltd., Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O3S2
InChI InChI=1S/C13H14O3S2/c1-9-3-5-11(6-4-9)17-13-8-18(15,16)7-12(13)10(2)14/h3-6H,7-8H2,1-2H3
InChIKey ARFMFZICAMXCCI-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 171-173C (dec.)
Molecular Weight 282.38
Solvent DMSO-d6; Reference=TMS; Temperature 297K