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ethyl (2E)-2-(3-allyl-4-hydroxy-5-methoxybenzylidene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
SpectraBase Compound ID JM3fR8Mm9fT
InChI InChI=1S/C27H26N2O5S/c1-5-10-19-13-17(14-20(33-4)24(19)30)15-21-25(31)29-23(18-11-8-7-9-12-18)22(26(32)34-6-2)16(3)28-27(29)35-21/h5,7-9,11-15,23,30H,1,6,10H2,2-4H3/b21-15+
InChIKey KATPKFLWLKGPSM-RCCKNPSSSA-N
Mol Weight 490.57 g/mol
Molecular Formula C27H26N2O5S
Exact Mass 490.156243 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID H3eZNNlA86M
Name ethyl (2E)-2-(3-allyl-4-hydroxy-5-methoxybenzylidene)-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/C27H26N2O5S/c1-5-10-19-13-17(14-20(33-4)24(19)30)15-21-25(31)29-23(18-11-8-7-9-12-18)22(26(32)34-6-2)16(3)28-27(29)35-21/h5,7-9,11-15,23,30H,1,6,10H2,2-4H3/b21-15+
InChIKey KATPKFLWLKGPSM-RCCKNPSSSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_8015
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: 9686399; UBI_ID: UBI-008018
Synonyms ethyl 2-(3-allyl-4-hydroxy-5-methoxybenzylidene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Temperature 318 °C