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5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid, 5-(4-chlorophenyl)-2-[(3-ethoxy-4-hydroxy-5-iodophenyl)methylene]-2,3-dihydro-7-methyl-3-oxo-, ethyl
SpectraBase Compound ID IZsY0XNZuvh
InChI InChI=1S/C25H22ClIN2O5S/c1-4-33-18-11-14(10-17(27)22(18)30)12-19-23(31)29-21(15-6-8-16(26)9-7-15)20(24(32)34-5-2)13(3)28-25(29)35-19/h6-12,21,30H,4-5H2,1-3H3/b19-12+
InChIKey NNRUTYNQKUQNMO-XDHOZWIPSA-N
Mol Weight 624.88 g/mol
Molecular Formula C25H22ClIN2O5S
Exact Mass 623.998266 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HKdqSgNHwTb
Name 5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid, 5-(4-chlorophenyl)-2-[(3-ethoxy-4-hydroxy-5-iodophenyl)methylene]-2,3-dihydro-7-methyl-3-oxo-, ethyl
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 623.998265685 u
Formula C25H22ClIN2O5S
InChI InChI=1S/C25H22ClIN2O5S/c1-4-33-18-11-14(10-17(27)22(18)30)12-19-23(31)29-21(15-6-8-16(26)9-7-15)20(24(32)34-5-2)13(3)28-25(29)35-19/h6-12,21,30H,4-5H2,1-3H3/b19-12+
InChIKey NNRUTYNQKUQNMO-XDHOZWIPSA-N
Molecular Weight 624.877 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_471
Solvent DMSO-d6
Source Vendor ID: ZI/8027559; Lab Info: LD; Lab Number: LD-1300139
Temperature 29.85 °C