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7-bromo-3-methyl-2-(methylsulfanyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione

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7-bromo-3-methyl-2-(methylsulfanyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
SpectraBase Compound ID 4tcFypnAW0w
InChI InChI=1S/C13H9BrN2O3S/c1-16-12(18)9-10(17)7-5-6(14)3-4-8(7)19-11(9)15-13(16)20-2/h3-5H,1-2H3
InChIKey ITTLCLUGGPEVCA-UHFFFAOYSA-N
Mol Weight 353.19 g/mol
Molecular Formula C13H9BrN2O3S
Exact Mass 351.951726 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6bXxCDO79Bn
Name 7-bromo-3-methyl-2-(methylsulfanyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C13H9BrN2O3S/c1-16-12(18)9-10(17)7-5-6(14)3-4-8(7)19-11(9)15-13(16)20-2/h3-5H,1-2H3
InChIKey ITTLCLUGGPEVCA-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_34986
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: E82923; SBI_ID: SBI-034990
Temperature 298 °C