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methyl (6-oxo-2-{[(E)-{[(E)-oxo(phenyl)methyl]imino}(2-toluidino)methyl]amino}-3,6-dihydro-4-pyrimidinyl)acetate
SpectraBase Compound ID 7oUviiOJ0j3
InChI InChI=1S/C22H21N5O4/c1-14-8-6-7-11-17(14)24-22(26-20(30)15-9-4-3-5-10-15)27-21-23-16(12-18(28)25-21)13-19(29)31-2/h3-12H,13H2,1-2H3,(H3,23,24,25,26,27,28,30)
InChIKey JYCSXRHHPBJLRM-UHFFFAOYSA-N
Mol Weight 419.44 g/mol
Molecular Formula C22H21N5O4
Exact Mass 419.159354 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2E0UkCNLgS
Name methyl (6-oxo-2-{[(E)-{[(E)-oxo(phenyl)methyl]imino}(2-toluidino)methyl]amino}-3,6-dihydro-4-pyrimidinyl)acetate
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/C22H21N5O4/c1-14-8-6-7-11-17(14)24-22(26-20(30)15-9-4-3-5-10-15)27-21-23-16(12-18(28)25-21)13-19(29)31-2/h3-12H,13H2,1-2H3,(H3,23,24,25,26,27,28,30)
InChIKey JYCSXRHHPBJLRM-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_6887
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: D27099; Labnumber: VGU-0018829; SBI_ID: SBI-006890
Synonyms methyl (6-oxo-2-{[{[oxo(phenyl)methyl]imino}(2-toluidino)methyl]amino}-3,6-dihydro-4-pyrimidinyl)acetate
Temperature 318 °C