| SpectraBase Compound ID | DJJ6EnkikPq |
|---|---|
| InChI | InChI=1S/C14H14ClN3O3S/c1-3-21-14(20)10-11(16)18(17-12(10)22-2)13(19)8-4-6-9(15)7-5-8/h4-7H,3,16H2,1-2H3 |
| InChIKey | MHTLUZMZRVOUKL-UHFFFAOYSA-N |
| Mol Weight | 339.8 g/mol |
| Molecular Formula | C14H14ClN3O3S |
| Exact Mass | 339.04444 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LNj8HH6Pudk |
|---|---|
| Name | 5-AMINO-1-(4-CHLOROBENZOYL-3-METHYLSULFANYL-1H-PYRAZOLE-4-CARBOXYLIC-ACID-ETHYLESTER |
| Compound Number | 7B |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C14H14ClN3O3S/c1-3-21-14(20)10-11(16)18(17-12(10)22-2)13(19)8-4-6-9(15)7-5-8/h4-7H,3,16H2,1-2H3 |
| InChIKey | MHTLUZMZRVOUKL-UHFFFAOYSA-N |
| Literature Reference | M.JOCHHEIM,H.G.KRUG,R.NEIDLEIN,C.KRIEGER HETEROCYCLES,41,1235(1995) |
| Solvent | Chloroform-d |