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2-[(4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]phenyl 4-(acetylamino)benzenesulfonate
SpectraBase Compound ID KORF67WqhFS
InChI InChI=1S/C19H15N3O6S2/c1-11(23)20-13-6-8-14(9-7-13)30(26,27)28-16-5-3-2-4-12(16)10-15-17(24)21-19(29)22-18(15)25/h2-10H,1H3,(H,20,23)(H2,21,22,24,25,29)
InChIKey GSLISMDLFDORJL-UHFFFAOYSA-N
Mol Weight 445.46 g/mol
Molecular Formula C19H15N3O6S2
Exact Mass 445.040228 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1kyxlbkdBiD
Name 2-[(4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]phenyl 4-(acetylamino)benzenesulfonate
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/C19H15N3O6S2/c1-11(23)20-13-6-8-14(9-7-13)30(26,27)28-16-5-3-2-4-12(16)10-15-17(24)21-19(29)22-18(15)25/h2-10H,1H3,(H,20,23)(H2,21,22,24,25,29)
InChIKey GSLISMDLFDORJL-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_11957
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: 1003267; UBI_ID: UBI-011960
Temperature 318 °C