![N-[(+-)-1'-(2",3",4",5",6"-Pentafluorophenyl)ethyl]-5-phenylsulfanylpyrrolidin-2-one](/api/spectrum/DCcJ8dF9eA5/structure.png?h=300&w=458 "N-[(+-)-1'-(2\",3\",4\",5\",6\"-Pentafluorophenyl)ethyl]-5-phenylsulfanylpyrrolidin-2-one")
| SpectraBase Compound ID | HQnYC0rHaGz |
|---|---|
| InChI | InChI=1S/C18H14F5NOS/c1-9(13-14(19)16(21)18(23)17(22)15(13)20)24-11(25)7-8-12(24)26-10-5-3-2-4-6-10/h2-6,9,12H,7-8H2,1H3 |
| InChIKey | COBBWALAKYJHLZ-UHFFFAOYSA-N |
| Mol Weight | 387.37 g/mol |
| Molecular Formula | C18H14F5NOS |
| Exact Mass | 387.071626 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DCcJ8dF9eA5 |
|---|---|
| Name | N-[(+-)-1'-(2",3",4",5",6"-Pentafluorophenyl)ethyl]-5-phenylsulfanylpyrrolidin-2-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H14F5NOS |
| InChI | InChI=1S/C18H14F5NOS/c1-9(13-14(19)16(21)18(23)17(22)15(13)20)24-11(25)7-8-12(24)26-10-5-3-2-4-6-10/h2-6,9,12H,7-8H2,1H3 |
| InChIKey | COBBWALAKYJHLZ-UHFFFAOYSA-N |
| Molecular Weight | 387.368 g/mol |
| SMILES | c1(c(c(F)c(c(c1F)F)F)F)C(N1C(Sc2ccccc2)CCC1=O)C |
| SPLASH | splash10-003r-9170000000-8454ea31318b291f46cd |
| Source of Spectrum | KC-0-1110-10 |
| Synonyms | N-[(+-)-1'-(2'',3'',4'',5'',6''-Pentafluorophenyl)ethyl]-5-phenylsulfanylpyrrolidin-2-one 1-[1-(2,3,4,5,6-pentafluorophenyl)ethyl]-5-(phenylthio)-2-pyrrolidinone 1-[1-(2,3,4,5,6-pentafluorophenyl)ethyl]-5-phenylsulfanylpyrrolidin-2-one 1-[1-(2,3,4,5,6-pentafluorophenyl)ethyl]-5-phenylsulfanyl-pyrrolidin-2-one 1-[1-[2,3,4,5,6-pentakis(fluoranyl)phenyl]ethyl]-5-phenylsulfanyl-pyrrolidin-2-one |
| Wiley ID | 785688 |