| SpectraBase Spectrum ID |
BhyLjSkc24J |
| Name |
5-Hydroxy-4,5-dimethyl-1-phenyl-2-thioxo-2,5-dihydro-1H-pyrrole-3-carbonitrile |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H12N2OS |
| InChI |
InChI=1S/C13H12N2OS/c1-9-11(8-14)12(17)15(13(9,2)16)10-6-4-3-5-7-10/h3-7,16H,1-2H3 |
| InChIKey |
QDNZEXRJJJLMFT-UHFFFAOYSA-N |
| Molecular Weight |
244.312 g/mol |
| SMILES |
OC1(N(C(C(C#N)=C1C)=S)c1ccccc1)C |
| SPLASH |
splash10-0002-0090000000-8dddf99aaf20364e8b28 |
| Source of Spectrum |
B-52-65-7 |
| Wiley ID |
746275 |
