| SpectraBase Spectrum ID |
9NDxhOjtFDV |
| Name |
2-(2-Adamantan-1-yl-2-oxo-ethylsulfanyl)-6-methyl-4-trifluoromethyl-nicotinonitrile |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H21F3N2OS |
| InChI |
InChI=1S/C20H21F3N2OS/c1-11-2-16(20(21,22)23)15(9-24)18(25-11)27-10-17(26)19-6-12-3-13(7-19)5-14(4-12)8-19/h2,12-14H,3-8,10H2,1H3/t12-,13+,14-,19- |
| InChIKey |
QKNQRDRBZZWDCP-KRFSREQESA-N |
| Molecular Weight |
394.456 g/mol |
| SMILES |
c1(c(nc(cc1C(F)(F)F)C)SCC(C12C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])=O)C#N |
| SPLASH |
splash10-000i-6900000000-03ca8819d2b16855836d |
| Synonyms |
2-[2-(1-adamantyl)-2-oxidanylidene-ethyl]sulfanyl-6-methyl-4-(trifluoromethyl)pyridine-3-carbonitrile
2-[2-(1-adamantyl)-2-oxo-ethyl]sulfanyl-6-methyl-4-(trifluoromethyl)pyridine-3-carbonitrile
2-[[2-(1-adamantyl)-2-keto-ethyl]thio]-6-methyl-4-(trifluoromethyl)nicotinonitrile
2-[[2-(1-adamantyl)-2-oxoethyl]thio]-6-methyl-4-(trifluoromethyl)-3-pyridinecarbonitrile |
| Wiley ID |
1465772 |
