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5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid, 2-[[2-[(3,4-dichlorophenyl)methoxy]phenyl]methylene]-5-(4-fluorophenyl)-2,3-dihydro-7-methyl-3-oxo-, ethyl ester, (2Z)-
SpectraBase Compound ID FXw3AL4zJPi
InChI InChI=1S/C30H23Cl2FN2O4S/c1-3-38-29(37)26-17(2)34-30-35(27(26)19-9-11-21(33)12-10-19)28(36)25(40-30)15-20-6-4-5-7-24(20)39-16-18-8-13-22(31)23(32)14-18/h4-15,27H,3,16H2,1-2H3/b25-15-
InChIKey HSWLCWLGWMDFQE-MYYYXRDXSA-N
Mol Weight 597.49 g/mol
Molecular Formula C30H23Cl2FN2O4S
Exact Mass 596.073962 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID i0FlBdr1WL
Name 5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid, 2-[[2-[(3,4-dichlorophenyl)methoxy]phenyl]methylene]-5-(4-fluorophenyl)-2,3-dihydro-7-methyl-3-oxo-, ethyl ester, (2Z)-
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/C30H23Cl2FN2O4S/c1-3-38-29(37)26-17(2)34-30-35(27(26)19-9-11-21(33)12-10-19)28(36)25(40-30)15-20-6-4-5-7-24(20)39-16-18-8-13-22(31)23(32)14-18/h4-15,27H,3,16H2,1-2H3/b25-15-
InChIKey HSWLCWLGWMDFQE-MYYYXRDXSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_1192
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: NMR/11259286