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5-pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-1,6-dimethyl-4-(4-methyl-3-nitrophenyl)-2-oxo-, phenylmethyl ester
SpectraBase Compound ID JVkNDi4cPG0
InChI InChI=1S/C21H21N3O5/c1-13-9-10-16(11-17(13)24(27)28)19-18(14(2)23(3)21(26)22-19)20(25)29-12-15-7-5-4-6-8-15/h4-11,19H,12H2,1-3H3,(H,22,26)
InChIKey PPRJVZXWFZCHBN-UHFFFAOYSA-N
Mol Weight 395.42 g/mol
Molecular Formula C21H21N3O5
Exact Mass 395.148121 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5O5CtCU17l9
Name 5-pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-1,6-dimethyl-4-(4-methyl-3-nitrophenyl)-2-oxo-, phenylmethyl ester
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/C21H21N3O5/c1-13-9-10-16(11-17(13)24(27)28)19-18(14(2)23(3)21(26)22-19)20(25)29-12-15-7-5-4-6-8-15/h4-11,19H,12H2,1-3H3,(H,22,26)
InChIKey PPRJVZXWFZCHBN-UHFFFAOYSA-N
NMR Offset 16.1752
NMR Spectrometer Frequency 200.133
Observed nucleus 1H
Origin 1H_CB_8313_1885
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: NMR/9234110; Labnumber: SAS-TST0930
Temperature 313 °C