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ethyl (2E)-5-(4-tert-butylphenyl)-2-(4-chlorobenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
SpectraBase Compound ID EVXISUXuarm
InChI InChI=1S/C27H27ClN2O3S/c1-6-33-25(32)22-16(2)29-26-30(23(22)18-9-11-19(12-10-18)27(3,4)5)24(31)21(34-26)15-17-7-13-20(28)14-8-17/h7-15,23H,6H2,1-5H3/b21-15+
InChIKey QPVLAVVCJWRGLQ-RCCKNPSSSA-N
Mol Weight 495.04 g/mol
Molecular Formula C27H27ClN2O3S
Exact Mass 494.143092 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CWMYIP0fy61
Name ethyl (2E)-5-(4-tert-butylphenyl)-2-(4-chlorobenzylidene)-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/C27H27ClN2O3S/c1-6-33-25(32)22-16(2)29-26-30(23(22)18-9-11-19(12-10-18)27(3,4)5)24(31)21(34-26)15-17-7-13-20(28)14-8-17/h7-15,23H,6H2,1-5H3/b21-15+
InChIKey QPVLAVVCJWRGLQ-RCCKNPSSSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_768
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: 602723EXKam0481; Labnumber: 602723EXKam0481; VK_ID: VK-000769
Synonyms ethyl 5-(4-tert-butylphenyl)-2-(4-chlorobenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Temperature 318 °C