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ethyl (2E)-2-(1,3-benzodioxol-5-ylmethylene)-5-(4-fluorophenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
SpectraBase Compound ID 23Kb5zQr5nE
InChI InChI=1S/C24H19FN2O5S/c1-3-30-23(29)20-13(2)26-24-27(21(20)15-5-7-16(25)8-6-15)22(28)19(33-24)11-14-4-9-17-18(10-14)32-12-31-17/h4-11,21H,3,12H2,1-2H3/b19-11+
InChIKey PMIYVKOMQJAASG-YBFXNURJSA-N
Mol Weight 466.48 g/mol
Molecular Formula C24H19FN2O5S
Exact Mass 466.099871 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EQkwPckASBG
Name ethyl (2E)-2-(1,3-benzodioxol-5-ylmethylene)-5-(4-fluorophenyl)-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/C24H19FN2O5S/c1-3-30-23(29)20-13(2)26-24-27(21(20)15-5-7-16(25)8-6-15)22(28)19(33-24)11-14-4-9-17-18(10-14)32-12-31-17/h4-11,21H,3,12H2,1-2H3/b19-11+
InChIKey PMIYVKOMQJAASG-YBFXNURJSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_3113
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: 113018; Labnumber: PAVL-05237; VK_ID: VK-003114
Synonyms ethyl 2-(1,3-benzodioxol-5-ylmethylene)-5-(4-fluorophenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Temperature 308 °C