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5-pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-4-(4-hydroxy-3-nitrophenyl)-6-methyl-2-oxo-, 1,3-benzodioxol-5-ylmethyl ester

View entire compound with spectra: 1 NMR

5-pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-4-(4-hydroxy-3-nitrophenyl)-6-methyl-2-oxo-, 1,3-benzodioxol-5-ylmethyl ester
SpectraBase Compound ID AXXh9hDPMXA
InChI InChI=1S/C20H17N3O8/c1-10-17(19(25)29-8-11-2-5-15-16(6-11)31-9-30-15)18(22-20(26)21-10)12-3-4-14(24)13(7-12)23(27)28/h2-7,18,24H,8-9H2,1H3,(H2,21,22,26)
InChIKey FPNXIVROYZHXGI-UHFFFAOYSA-N
Mol Weight 427.37 g/mol
Molecular Formula C20H17N3O8
Exact Mass 427.101565 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7LKoQanr07V
Name 5-pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-4-(4-hydroxy-3-nitrophenyl)-6-methyl-2-oxo-, 1,3-benzodioxol-5-ylmethyl 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/C20H17N3O8/c1-10-17(19(25)29-8-11-2-5-15-16(6-11)31-9-30-15)18(22-20(26)21-10)12-3-4-14(24)13(7-12)23(27)28/h2-7,18,24H,8-9H2,1H3,(H2,21,22,26)
InChIKey FPNXIVROYZHXGI-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_433
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/11258206