| SpectraBase Spectrum ID |
HIrFKDo2iQ9 |
| Name |
(5-Benzoyl-5-hydroxy-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl)(thien-2-yl)methanone |
| Appearance |
Light yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H16N2O3S |
| InChI |
InChI=1S/C21H16N2O3S/c24-19(16-10-5-2-6-11-16)21(26)14-17(15-8-3-1-4-9-15)22-23(21)20(25)18-12-7-13-27-18/h1-13,26H,14H2 |
| InChIKey |
ZKZIQKUMKXEPCD-UHFFFAOYSA-N |
| Instrument Name |
Finnigan MAT 8200 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3762/bjoc.15.136 |
| Molecular Weight |
376.430 g/mol |
| SMILES |
OC1(C(c2ccccc2)=O)N(N=C(C1)c1ccccc1)C(=O)c1sccc1 |
| SPLASH |
splash10-03k9-0970000000-d3b7130b38b1bcf9b5f1 |
| Source of Spectrum |
BJO-15-SM12-5e |
| Thin-Layer Chromatography |
Rf = 0.16 (petroleum ether/ethyl acetate, 5:1) |
| Wiley ID |
1840927 |
