| SpectraBase Compound ID | JeiTYWVuTYo |
|---|---|
| InChI | InChI=1S/C21H4F10N2O2S/c22-9-7(10(23)14(27)17(30)13(9)26)19(34)32-5-3-1-2-4-6(5)33(21(32)36)20(35)8-11(24)15(28)18(31)16(29)12(8)25/h1-4H |
| InChIKey | SCOBDOANQAXBJI-UHFFFAOYSA-N |
| Mol Weight | 538.32 g/mol |
| Molecular Formula | C21H4F10N2O2S |
| Exact Mass | 537.98338 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | J42LH8sMXv3 |
|---|---|
| Name | 1,3-bis(2,3,4,5,6-pentafluorobenzoyl)-1,3-dihydro-2H-benzimidazole-2-thione |
| Alternate Name(s) | [2,3,4,5,6-pentakis(fluoranyl)phenyl]-[3-[2,3,4,5,6-pentakis(fluoranyl)phenyl]carbonyl-2-sulfanylidene-benzimidazol-1-yl]methanone [3-(2,3,4,5,6-pentafluorobenzoyl)-2-sulfanylidenebenzimidazol-1-yl]-(2,3,4,5,6-pentafluorophenyl)methanone [3-(2,3,4,5,6-pentafluorobenzoyl)-2-thioxo-benzimidazol-1-yl]-(2,3,4,5,6-pentafluorophenyl)methanone [3-[oxo-(2,3,4,5,6-pentafluorophenyl)methyl]-2-sulfanylidene-1-benzimidazolyl]-(2,3,4,5,6-pentafluorophenyl)methanone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H4F10N2O2S |
| InChI | InChI=1S/C21H4F10N2O2S/c22-9-7(10(23)14(27)17(30)13(9)26)19(34)32-5-3-1-2-4-6(5)33(21(32)36)20(35)8-11(24)15(28)18(31)16(29)12(8)25/h1-4H |
| InChIKey | SCOBDOANQAXBJI-UHFFFAOYSA-N |
| Molecular Weight | 538.319 g/mol |
| SMILES | C1(N(c2c(N1C(c1c(c(F)c(c(c1F)F)F)F)=O)cccc2)C(c1c(c(F)c(c(c1F)F)F)F)=O)=S |
| SPLASH | splash10-0002-0900030000-08a348d29bdcad107e70 |
| Source of Spectrum | J-59-7691-8 |
| Wiley ID | 1404252 |