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2,4(1H,3H)-pyrimidinedione, 1,3-dimethyl-5-nitro-6-[(E)-2-(2-thienyl)ethenyl]-
SpectraBase Compound ID 3D9qEuWKLpU
InChI InChI=1S/C12H11N3O4S/c1-13-9(6-5-8-4-3-7-20-8)10(15(18)19)11(16)14(2)12(13)17/h3-7H,1-2H3/b6-5+
InChIKey QUGSBXRCIFAORV-AATRIKPKSA-N
Mol Weight 293.3 g/mol
Molecular Formula C12H11N3O4S
Exact Mass 293.047027 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID K7s0Eyy0WqX
Name 2,4(1H,3H)-pyrimidinedione, 1,3-dimethyl-5-nitro-6-[(E)-2-(2-thienyl)ethenyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 293.047027016 u
Formula C12H11N3O4S
InChI InChI=1S/C12H11N3O4S/c1-13-9(6-5-8-4-3-7-20-8)10(15(18)19)11(16)14(2)12(13)17/h3-7H,1-2H3/b6-5+
InChIKey QUGSBXRCIFAORV-AATRIKPKSA-N
Molecular Weight 293.297 g/mol
NMR Offset 17.9881
NMR Spectrometer Frequency 500.132
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_18219
Solvent CDCl3
Source Vendor ID: NMR/11250938; Lab Info: TYN; Lab Number: TYN-0000042