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{2-bromo-6-ethoxy-4-[5-(methoxycarbonyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-4-pyrimidinyl]phenoxy}acetic acid
SpectraBase Compound ID AAO55Q7JDLz
InChI InChI=1S/C17H19BrN2O6S/c1-4-25-11-6-9(5-10(18)15(11)26-7-12(21)22)14-13(16(23)24-3)8(2)19-17(27)20-14/h5-6,14H,4,7H2,1-3H3,(H,21,22)(H2,19,20,27)
InChIKey ZDOGFKZBNZMBAR-UHFFFAOYSA-N
Mol Weight 459.31 g/mol
Molecular Formula C17H19BrN2O6S
Exact Mass 458.014721 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EbUxgaKCvS9
Name {2-bromo-6-ethoxy-4-[5-(methoxycarbonyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-4-pyrimidinyl]phenoxy}acetic acid
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/C17H19BrN2O6S/c1-4-25-11-6-9(5-10(18)15(11)26-7-12(21)22)14-13(16(23)24-3)8(2)19-17(27)20-14/h5-6,14H,4,7H2,1-3H3,(H,21,22)(H2,19,20,27)
InChIKey ZDOGFKZBNZMBAR-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_13093
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/9049007; UBI_ID: UBI-013096
Temperature 308 °C