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4-[(4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]phenyl 4-(acetylamino)benzenesulfonate
SpectraBase Compound ID 9MVxwJHj7ns
InChI InChI=1S/C19H15N3O6S2/c1-11(23)20-13-4-8-15(9-5-13)30(26,27)28-14-6-2-12(3-7-14)10-16-17(24)21-19(29)22-18(16)25/h2-10H,1H3,(H,20,23)(H2,21,22,24,25,29)
InChIKey ASLNPCKEZHFSCW-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 5BDI5Wrnk9Q
Name 4-[(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)20-13-4-8-15(9-5-13)30(26,27)28-14-6-2-12(3-7-14)10-16-17(24)21-19(29)22-18(16)25/h2-10H,1H3,(H,20,23)(H2,21,22,24,25,29)
InChIKey ASLNPCKEZHFSCW-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_7556
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: UZI/1008883; UBI_ID: UBI-007559
Temperature 308 °C