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4-{[(1-methylimidazol-2-yl)thio]methyl}-2-phenyl-5-thiazolecarboxylic acid, ethyl ester

View entire compound with spectra: 2 NMR, and 1 FTIR

4-{[(1-methylimidazol-2-yl)thio]methyl}-2-phenyl-5-thiazolecarboxylic acid, ethyl ester
SpectraBase Compound ID 4ck0wLjl8Ab
InChI InChI=1S/C17H17N3O2S2/c1-3-22-16(21)14-13(11-23-17-18-9-10-20(17)2)19-15(24-14)12-7-5-4-6-8-12/h4-10H,3,11H2,1-2H3
InChIKey UGDMJRLMIBUCBL-UHFFFAOYSA-N
Mol Weight 359.46 g/mol
Molecular Formula C17H17N3O2S2
Exact Mass 359.076219 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EljHdJe1dET
Name 4-{[(1-METHYLIMIDAZOL-2-YL)THIO]METHYL}-2-PHENYL-5-THIAZOLECARBOXYLIC ACID, ETHYL ESTER
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17N3O2S2
InChI InChI=1S/C17H17N3O2S2/c1-3-22-16(21)14-13(11-23-17-18-9-10-20(17)2)19-15(24-14)12-7-5-4-6-8-12/h4-10H,3,11H2,1-2H3
InChIKey UGDMJRLMIBUCBL-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 89-92C
Molecular Weight 359.47
Solvent CDCl3; Reference=TMS; Temperature 297K