| SpectraBase Spectrum ID |
CrbJWC06EQh |
| Name |
(1-methyl-5-methylsulfanyl-1H-pyrazol-3-yl)-phenyl-methanone |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H12N2OS |
| InChI |
InChI=1S/C12H12N2OS/c1-14-11(16-2)8-10(13-14)12(15)9-6-4-3-5-7-9/h3-8H,1-2H3 |
| InChIKey |
NBWJVTAOKXCMQJ-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1021/ol901208d |
| Molecular Weight |
232.301 g/mol |
| SMILES |
c1([n](nc(c1)C(c1ccccc1)=O)C)SC |
| SPLASH |
splash10-053r-2790000000-b755e7c290562b8a2105 |
| Source of Spectrum |
A1-11-3326/SM13-9a |
| Synonyms |
(1-methyl-5-(methylthio)-1H-pyrazol-3-yl)(phenyl)methanone |
| Wiley ID |
1757047 |
