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5-{[(5-hydroxy-4-phenyl-4H-1,2,4-triazol-3-yl)thio]methyl}-3-isoxazolecarboxylic acid, ethyl ester
SpectraBase Compound ID Bl75HBkO4dY
InChI InChI=1S/C15H14N4O4S/c1-2-22-13(20)12-8-11(23-18-12)9-24-15-17-16-14(21)19(15)10-6-4-3-5-7-10/h3-8H,2,9H2,1H3,(H,16,21)
InChIKey ZALVFPLOWCUKBL-UHFFFAOYSA-N
Mol Weight 346.36 g/mol
Molecular Formula C15H14N4O4S
Exact Mass 346.073576 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GT7FEVBvH6B
Name 5-{[(5-HYDROXY-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL)THIO]METHYL}-3-ISOXAZOLECARBOXYLIC 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 C15H14N4O4S
InChI InChI=1S/C15H14N4O4S/c1-2-22-13(20)12-8-11(23-18-12)9-24-15-17-16-14(21)19(15)10-6-4-3-5-7-10/h3-8H,2,9H2,1H3,(H,16,21)
InChIKey ZALVFPLOWCUKBL-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 160-162C
Molecular Weight 346.37
Solvent Polysol; Reference=TMS; Temperature 297K