| SpectraBase Spectrum ID |
DADsP9jDXTM |
| Name |
1-Phenyl-5-(3-thienylethynyl)-3-(trifluoromethyl)-1H-pyrazole-4-carbaldehyde |
| Appearance |
Light brown crystals |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H9F3N2OS |
| InChI |
InChI=1S/C17H9F3N2OS/c18-17(19,20)16-14(10-23)15(7-6-12-8-9-24-11-12)22(21-16)13-4-2-1-3-5-13/h1-5,8-11H |
| InChIKey |
XHRXAZWWWMORAO-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu QP 1000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3762/bjoc.10.183 |
| Molecular Weight |
346.327 g/mol |
| Reported Formula |
C17H9F3N2OS |
| SMILES |
c1c(cccc1)-[n]1nc(c(c1C#Cc1cscc1)C=O)C(F)(F)F |
| SPLASH |
splash10-0002-3009000000-2b63c1de0257dd2d69cf |
| Source of Spectrum |
BJO-10-SM3-4b |
| Wiley ID |
1853949 |
