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ethanone, 1-(3,4-dihydroxyphenyl)-2-[(4-hydroxy-5,6-dimethylthieno[2,3-d]pyrimidin-2-yl)thio]-
SpectraBase Compound ID fmfWtG6PDH
InChI InChI=1S/C16H14N2O4S2/c1-7-8(2)24-15-13(7)14(22)17-16(18-15)23-6-12(21)9-3-4-10(19)11(20)5-9/h3-5,19-20H,6H2,1-2H3,(H,17,18,22)
InChIKey FBFZQTVPMLIDPV-UHFFFAOYSA-N
Mol Weight 362.42 g/mol
Molecular Formula C16H14N2O4S2
Exact Mass 362.039499 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1KhlaRAU2jM
Name ethanone, 1-(3,4-dihydroxyphenyl)-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 362.039499283 u
Formula C16H14N2O4S2
InChI InChI=1S/C16H14N2O4S2/c1-7-8(2)24-15-13(7)14(22)17-16(18-15)23-6-12(21)9-3-4-10(19)11(20)5-9/h3-5,19-20H,6H2,1-2H3,(H,17,18,22)
InChIKey FBFZQTVPMLIDPV-UHFFFAOYSA-N
Molecular Weight 362.418 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16966
Solvent DMSO-d6
Source Vendor ID: ZI/10061195; Lab Info: MIH; Lab Number: MIH-0001059