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methyl (2E)-2-({5-[(3-chloro-4-fluorophenoxy)methyl]-2-furyl}methylene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
SpectraBase Compound ID Bh7edc1YGT3
InChI InChI=1S/C27H20ClFN2O5S/c1-15-23(26(33)34-2)24(16-6-4-3-5-7-16)31-25(32)22(37-27(31)30-15)13-18-8-9-19(36-18)14-35-17-10-11-21(29)20(28)12-17/h3-13,24H,14H2,1-2H3/b22-13+
InChIKey IQYLZAQDRXHDMS-LPYMAVHISA-N
Mol Weight 538.98 g/mol
Molecular Formula C27H20ClFN2O5S
Exact Mass 538.076549 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FpbHIATKMYt
Name methyl (2E)-2-({5-[(3-chloro-4-fluorophenoxy)methyl]-2-furyl}methylene)-7-methyl-3-oxo-5-phenyl-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/C27H20ClFN2O5S/c1-15-23(26(33)34-2)24(16-6-4-3-5-7-16)31-25(32)22(37-27(31)30-15)13-18-8-9-19(36-18)14-35-17-10-11-21(29)20(28)12-17/h3-13,24H,14H2,1-2H3/b22-13+
InChIKey IQYLZAQDRXHDMS-LPYMAVHISA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_8808
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/1026538; Labnumber: FED0394; UZI_ID: UZI-008810
Synonyms methyl 2-({5-[(3-chloro-4-fluorophenoxy)methyl]-2-furyl}methylene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Temperature 318 °C