| SpectraBase Compound ID | GKCtHzd0kye |
|---|---|
| InChI | InChI=1S/C15H4F11N3O3S/c16-11(17,12(18,19)13(20,21)14(22,23)15(24,25)26)8-4-9(30)28-6-2-1-5(29(31)32)3-7(6)33-10(28)27-8/h1-4H |
| InChIKey | SMOXTRBVDOBFTA-UHFFFAOYSA-N |
| Mol Weight | 515.26 g/mol |
| Molecular Formula | C15H4F11N3O3S |
| Exact Mass | 514.979772 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KVhMDhnSk3q |
|---|---|
| Name | 7-Nitro-2-undecafluoropentyl-9-thia-1,4a-diaza-fluoren-4-one |
| Alternate Name(s) | 2-(1,1,2,2,3,3,4,4,5,5,5-undecafluoropentyl)-8-nitro-4H-pyrimido[2,1-b][1,3]benzothiazole-4-one 4-(1,1,1,2,2,3,3,4,4,5,5-undecafluoropentyl)-8-nitropyrimido[2,1-b]benzothiazole-2-one 8-Nitro-2-(1,1,2,2,3,3,4,4,5,5,5-undecafluoropentyl)-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one 8-Nitro-2-(1,1,2,2,3,3,4,4,5,5,5-undecafluoropentyl)-4-pyrimido[2,1-b][1,3]benzothiazolone 8-Nitro-2-[1,1,2,2,3,3,4,4,5,5,5-undecakis(fluoranyl)pentyl]pyrimido[2,1-b][1,3]benzothiazol-4-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H4F11N3O3S |
| InChI | InChI=1S/C15H4F11N3O3S/c16-11(17,12(18,19)13(20,21)14(22,23)15(24,25)26)8-4-9(30)28-6-2-1-5(29(31)32)3-7(6)33-10(28)27-8/h1-4H |
| InChIKey | SMOXTRBVDOBFTA-UHFFFAOYSA-N |
| Molecular Weight | 515.257 g/mol |
| SMILES | C(C(C(C(F)(F)F)(F)F)(F)F)(C(C=1N=C2Sc3cc(N(=O)=O)ccc3N2C(C1)=O)(F)F)(F)F |
| SPLASH | splash10-014i-0080290000-242e9ef7502ab711d6ca |
| Source of Spectrum | KC-0-986-8 |
| Wiley ID | 787809 |