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{3-[(Z)-(6-(ethoxycarbonyl)-7-methyl-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene)methyl]phenoxy}acetic acid
SpectraBase Compound ID 4q6wyo6dLUI
InChI InChI=1S/C25H22N2O6S/c1-3-32-24(31)21-15(2)26-25-27(22(21)17-9-5-4-6-10-17)23(30)19(34-25)13-16-8-7-11-18(12-16)33-14-20(28)29/h4-13,22H,3,14H2,1-2H3,(H,28,29)/b19-13-
InChIKey RYISJIZOLZLLOD-UYRXBGFRSA-N
Mol Weight 478.52 g/mol
Molecular Formula C25H22N2O6S
Exact Mass 478.119858 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 49eI2tmBBLN
Name {3-[(Z)-(6-(ethoxycarbonyl)-7-methyl-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene)methyl]phenoxy}acetic acid
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/C25H22N2O6S/c1-3-32-24(31)21-15(2)26-25-27(22(21)17-9-5-4-6-10-17)23(30)19(34-25)13-16-8-7-11-18(12-16)33-14-20(28)29/h4-13,22H,3,14H2,1-2H3,(H,28,29)/b19-13-
InChIKey RYISJIZOLZLLOD-UYRXBGFRSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_4956
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: 9674900; UBI_ID: UBI-004957
Synonyms {3-[(6-(ethoxycarbonyl)-7-methyl-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene)methyl]phenoxy}acetic acid
Temperature 308 °C