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1-(4-Ethylphenyl)-2-[(4-hydroxy-5,6-dimethylthieno[2,3-d]pyrimidin-2-yl)sulfanyl]ethanone
SpectraBase Compound ID FEUWh9dUoGR
InChI InChI=1S/C18H18N2O2S2/c1-4-12-5-7-13(8-6-12)14(21)9-23-18-19-16(22)15-10(2)11(3)24-17(15)20-18/h5-8H,4,9H2,1-3H3,(H,19,20,22)
InChIKey BXAYZCPAIUJSTK-UHFFFAOYSA-N
Mol Weight 358.47 g/mol
Molecular Formula C18H18N2O2S2
Exact Mass 358.08097 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JyQb8x6Mg0G
Name ethanone, 1-(4-ethylphenyl)-2-[(4-hydroxy-5,6-dimethylthieno[2,3-d]pyrimidin-2-yl)thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 358.080970174 u
Formula C18H18N2O2S2
InChI InChI=1S/C18H18N2O2S2/c1-4-12-5-7-13(8-6-12)14(21)9-23-18-19-16(22)15-10(2)11(3)24-17(15)20-18/h5-8H,4,9H2,1-3H3,(H,19,20,22)
InChIKey BXAYZCPAIUJSTK-UHFFFAOYSA-N
Molecular Weight 358.474 g/mol
NMR Offset 16.0087
NMR Spectrometer Frequency 500.133
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_4377
Solvent DMSO-d6
Source Vendor ID: ZI/9041440; Lab Info: mih; Lab Number: MIH-0000778