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ethyl (2E)-5-(4-fluorophenyl)-2-(2-hydroxy-3-nitrobenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
SpectraBase Compound ID EV2fd6pd0hn
InChI InChI=1S/C23H18FN3O6S/c1-3-33-22(30)18-12(2)25-23-26(19(18)13-7-9-15(24)10-8-13)21(29)17(34-23)11-14-5-4-6-16(20(14)28)27(31)32/h4-11,19,28H,3H2,1-2H3/b17-11+
InChIKey PLYYGKSYFRICHF-GZTJUZNOSA-N
Mol Weight 483.47 g/mol
Molecular Formula C23H18FN3O6S
Exact Mass 483.090035 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 72JmkBj9fQ5
Name ethyl (2E)-5-(4-fluorophenyl)-2-(2-hydroxy-3-nitrobenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
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/C23H18FN3O6S/c1-3-33-22(30)18-12(2)25-23-26(19(18)13-7-9-15(24)10-8-13)21(29)17(34-23)11-14-5-4-6-16(20(14)28)27(31)32/h4-11,19,28H,3H2,1-2H3/b17-11+
InChIKey PLYYGKSYFRICHF-GZTJUZNOSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_8618
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: 9685853; UBI_ID: UBI-008621
Synonyms ethyl 5-(4-fluorophenyl)-2-(2-hydroxy-3-nitrobenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Temperature 308 °C