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N-[(4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-4-hydroxyphenylalanine

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N-[(4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-4-hydroxyphenylalanine
SpectraBase Compound ID KFInmOC0irW
InChI InChI=1S/C14H13N3O5S/c18-8-3-1-7(2-4-8)5-10(13(21)22)15-6-9-11(19)16-14(23)17-12(9)20/h1-4,6,10,15,18H,5H2,(H,21,22)(H2,16,17,19,20,23)
InChIKey VDLBFWYYBFUNEN-UHFFFAOYSA-N
Mol Weight 335.33 g/mol
Molecular Formula C14H13N3O5S
Exact Mass 335.057592 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DuFdTYmSAT4
Name N-[(4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-4-hydroxyphenylalanine
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/C14H13N3O5S/c18-8-3-1-7(2-4-8)5-10(13(21)22)15-6-9-11(19)16-14(23)17-12(9)20/h1-4,6,10,15,18H,5H2,(H,21,22)(H2,16,17,19,20,23)
InChIKey VDLBFWYYBFUNEN-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_34980
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: E82911; SBI_ID: SBI-034984
Temperature 298 °C