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2-methoxy-4-[(2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]phenyl 4-methoxybenzenesulfonate
SpectraBase Compound ID 4PBmD16AXVO
InChI InChI=1S/C19H16N2O8S/c1-27-12-4-6-13(7-5-12)30(25,26)29-15-8-3-11(10-16(15)28-2)9-14-17(22)20-19(24)21-18(14)23/h3-10H,1-2H3,(H2,20,21,22,23,24)
InChIKey SDZZOIWVBRBSBN-UHFFFAOYSA-N
Mol Weight 432.4 g/mol
Molecular Formula C19H16N2O8S
Exact Mass 432.062737 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1xzsaaLUIHL
Name 2-methoxy-4-[(2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]phenyl 4-methoxybenzenesulfonate
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/C19H16N2O8S/c1-27-12-4-6-13(7-5-12)30(25,26)29-15-8-3-11(10-16(15)28-2)9-14-17(22)20-19(24)21-18(14)23/h3-10H,1-2H3,(H2,20,21,22,23,24)
InChIKey SDZZOIWVBRBSBN-UHFFFAOYSA-N
NMR Offset 16.0772
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_11130
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: 1003589; UBI_ID: UBI-011133
Temperature 308 °C