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propyl 2-chloro-5-{[(Z)-(1-(4-chlorophenyl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]amino}benzoate
SpectraBase Compound ID 58a6BlT2RK2
InChI InChI=1S/C21H17Cl2N3O5/c1-2-9-31-20(29)15-10-13(5-8-17(15)23)24-11-16-18(27)25-21(30)26(19(16)28)14-6-3-12(22)4-7-14/h3-8,10-11,24H,2,9H2,1H3,(H,25,27,30)/b16-11-
InChIKey DMYUXZXNCLFYAS-WJDWOHSUSA-N
Mol Weight 462.29 g/mol
Molecular Formula C21H17Cl2N3O5
Exact Mass 461.054526 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8EL5nue5xuQ
Name propyl 2-chloro-5-{[(Z)-(1-(4-chlorophenyl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]amino}benzoate
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/C21H17Cl2N3O5/c1-2-9-31-20(29)15-10-13(5-8-17(15)23)24-11-16-18(27)25-21(30)26(19(16)28)14-6-3-12(22)4-7-14/h3-8,10-11,24H,2,9H2,1H3,(H,25,27,30)/b16-11-
InChIKey DMYUXZXNCLFYAS-WJDWOHSUSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_15953
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/8055793; UBI_ID: UBI-015956
Synonyms propyl 2-chloro-5-{[(1-(4-chlorophenyl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]amino}benzoate
Temperature 313 °C