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2-methoxy-6-[(2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]phenyl benzenesulfonate
SpectraBase Compound ID 65qScRC6txg
InChI InChI=1S/C18H14N2O7S/c1-26-14-9-5-6-11(10-13-16(21)19-18(23)20-17(13)22)15(14)27-28(24,25)12-7-3-2-4-8-12/h2-10H,1H3,(H2,19,20,21,22,23)
InChIKey OCVQVKWAHDCWFR-UHFFFAOYSA-N
Mol Weight 402.38 g/mol
Molecular Formula C18H14N2O7S
Exact Mass 402.052172 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AN8j4YwXkMD
Name 2-methoxy-6-[(2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]phenyl 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/C18H14N2O7S/c1-26-14-9-5-6-11(10-13-16(21)19-18(23)20-17(13)22)15(14)27-28(24,25)12-7-3-2-4-8-12/h2-10H,1H3,(H2,19,20,21,22,23)
InChIKey OCVQVKWAHDCWFR-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_21230
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/9680942; UBI_ID: UBI-021234
Temperature 318 °C