| SpectraBase Spectrum ID |
1Y1YqJyv9BL |
| Name |
4-(2-Hydroxy-3,5-dimethylbenzoyl)-1-(piperidin-1-ylcarbonothioyl)-1H-pyrazole |
| Appearance |
Pale yellow crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H21N3O2S |
| InChI |
InChI=1S/C18H21N3O2S/c1-12-8-13(2)16(22)15(9-12)17(23)14-10-19-21(11-14)18(24)20-6-4-3-5-7-20/h8-11,22H,3-7H2,1-2H3 |
| InChIKey |
INYHPJVLHDUTSI-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu GC-2010 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.3291 |
| Molecular Weight |
343.445 g/mol |
| SMILES |
Oc1c(C(c2cn[n](c2)C(=S)N2CCCCC2)=O)cc(cc1C)C |
| SPLASH |
splash10-00pi-9731000000-5e177403abeab85ab798 |
| Source of Spectrum |
Y-55-2321-8 |
| Wiley ID |
1878861 |
