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3-{[(5-oxo-3-phenyl-2-pyrazolin-4-ylidene)methyl]amino}-2-thiophenecarboxylic acid, methyl ester
SpectraBase Compound ID DclIjqsF1FO
InChI InChI=1S/C16H13N3O3S/c1-22-16(21)14-12(7-8-23-14)17-9-11-13(18-19-15(11)20)10-5-3-2-4-6-10/h2-9,17H,1H3,(H,19,20)
InChIKey RVVAPTXJAZWWCU-UHFFFAOYSA-N
Mol Weight 327.36 g/mol
Molecular Formula C16H13N3O3S
Exact Mass 327.067762 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID L9dwSv7dqQ0
Name 3-{[(5-OXO-3-PHENYL-2-PYRAZOLIN-4-YLIDENE)METHYL]AMINO}-2-THIOPHENECARBOXYLIC ACID, METHYL ESTER
Source of Sample Bionet Research Ltd., Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13N3O3S
InChI InChI=1S/C16H13N3O3S/c1-22-16(21)14-12(7-8-23-14)17-9-11-13(18-19-15(11)20)10-5-3-2-4-6-10/h2-9,17H,1H3,(H,19,20)
InChIKey RVVAPTXJAZWWCU-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 256-258C
Molecular Weight 327.36
Solvent Polysol; Reference=TMS; Temperature 297K