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5-(dimethylsulfonio)-3-(2-fluorophenyl)-2,6-dioxo-1,2,3,6-tetrahydro-4-pyrimidinolate

View entire compound with spectra: 2 NMR

5-(dimethylsulfonio)-3-(2-fluorophenyl)-2,6-dioxo-1,2,3,6-tetrahydro-4-pyrimidinolate
SpectraBase Compound ID 7wPxwqpYr5r
InChI InChI=1S/C12H11FN2O3S/c1-19(2)9-10(16)14-12(18)15(11(9)17)8-6-4-3-5-7(8)13/h3-6H,1-2H3,(H-,14,16,17,18)
InChIKey PMXJXNDUYKAEDJ-UHFFFAOYSA-N
Mol Weight 282.29 g/mol
Molecular Formula C12H11FN2O3S
Exact Mass 282.047442 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 33zKVBgIAKc
Name [1-(2-fluorophenyl)-2-oxido-4,6-dioxo-1,4,5,6-tetrahydropyridin-3-yl]dimethylsulfanium
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 282.047441556 u
Formula C12H11FN2O3S
InChI InChI=1S/C12H11FN2O3S/c1-19(2)9-10(16)14-12(18)15(11(9)17)8-6-4-3-5-7(8)13/h3-6H,1-2H3,(H-,14,16,17,18)
InChIKey PMXJXNDUYKAEDJ-UHFFFAOYSA-N
Molecular Weight 282.289 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15337
Solvent DMSO-d6
Source Vendor ID: NMR/10321788; Lab Info: LP; Lab Number: LP-1708364