| SpectraBase Compound ID | 76DIxgWSy57 |
|---|---|
| InChI | InChI=1S/C10H15F3N6.HNO3/c1-5(2)3-6-4-7(10(11,12)13)17-9(16-6)19-18-8(14)15;2-1(3)4/h4-5H,3H2,1-2H3,(H4,14,15,18)(H,16,17,19);(H,2,3,4) |
| InChIKey | VFOBRFWBOLEGNL-UHFFFAOYSA-N |
| Mol Weight | 339.28 g/mol |
| Molecular Formula | C10H16F3N7O3 |
| Exact Mass | 339.126672 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HGfo3RbtmHc |
|---|---|
| Name | 2-Guanidinoamino-6-isobutyl-4-trifluormethylpyrimidine nitrate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H16F3N7O3 |
| InChI | InChI=1S/C10H15F3N6.HNO3/c1-5(2)3-6-4-7(10(11,12)13)17-9(16-6)19-18-8(14)15;2-1(3)4/h4-5H,3H2,1-2H3,(H4,14,15,18)(H,16,17,19);(H,2,3,4) |
| InChIKey | VFOBRFWBOLEGNL-UHFFFAOYSA-N |
| Molecular Weight | 339.279 g/mol |
| SMILES | O[N+](=O)[O-].N(c1nc(cc(n1)C(F)(F)F)CC(C)C)NC(N)=N |
| SPLASH | splash10-0036-0590000000-3bc2ce99253407fc8158 |
| Source of Spectrum | APC-313-247-3b |
| Synonyms | 2-(4-isobutyl-6-(trifluoromethyl)pyrimidin-2-yl)hydrazine-1-carboximidamide nitrate |
| Wiley ID | 1787853 |