| SpectraBase Compound ID | 7JsJoBV6LKD |
|---|---|
| InChI | InChI=1S/C8H2F3N3O4/c9-8(10,11)4-1-6(13(15)16)5(3-12)7(2-4)14(17)18/h1-2H |
| InChIKey | JVMGGCAIQROQMF-UHFFFAOYSA-N |
| Mol Weight | 261.12 g/mol |
| Molecular Formula | C8H2F3N3O4 |
| Exact Mass | 260.99974 g/mol |
19F Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HipSub2G1TX |
|---|---|
| Name | 3,5-DINITRO-4-CYANO-1-TRIFLUOROMETHYL-BENZENE |
| Compound Number | 542 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C8H2F3N3O4 |
| InChI | InChI=1S/C8H2F3N3O4/c9-8(10,11)4-1-6(13(15)16)5(3-12)7(2-4)14(17)18/h1-2H |
| InChIKey | JVMGGCAIQROQMF-UHFFFAOYSA-N |
| Literature Reference Author | W.ROBIEN |
| Literature Reference Citation | W.ROBIEN,PRIVATE_COMMUNICATION |
| Solvent | CDCl3 |
| Source File Reference | WRPR1687 |