![3-{[(5-oxo-3-phenyl-2-pyrazolin-4-ylidene)methyl]amino}-2-thiophenecarboxylic acid, methyl ester](/api/spectrum/CPmg4Cc0JfJ/structure.png?h=300&w=458 "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) Chemical Shifts
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| SpectraBase Spectrum ID | CPmg4Cc0JfJ |
|---|---|
| Name | 3-{[(5-oxo-3-phenyl-2-pyrazolin-4-ylidene)methyl]amino}-2-thiophenecarboxylic acid, methyl ester |
| Copyright | Copyright © 2009-2024 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 | Varian CFT-20 |
| Sadtler NMR Number | 57774M |
| Solvent | Polysol |