SpectraBase Compound ID | 6I8vZhpCgc |
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InChI | InChI=1S/C9H14F3N3O/c1-2-3-4-13-7-5-8(16)15(14-7)6-9(10,11)12/h2-6H2,1H3,(H,13,14) |
InChIKey | MNGTYKFWLFEJRS-UHFFFAOYSA-N |
Mol Weight | 237.23 g/mol |
Molecular Formula | C9H14F3N3O |
Exact Mass | 237.108897 g/mol |
SpectraBase Spectrum ID | S6sXfIUljK |
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Name | 3-(BUTYLAMINO)-1-(2,2,2-TRIFLUOROETHYL)-2-PYRAZOLIN-5-ONE |
Source of Sample | Aldrich Chemical Company, Inc., Milwaukee, Wisconsin |
Copyright | Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C9H14F3N3O |
InChI | InChI=1S/C9H14F3N3O/c1-2-3-4-13-7-5-8(16)15(14-7)6-9(10,11)12/h2-6H2,1H3,(H,13,14) |
InChIKey | MNGTYKFWLFEJRS-UHFFFAOYSA-N |
Instrument Name | BRUKER AC-300 |
Molecular Weight | 237.23 |
Solvent | CDCl3; Reference=TMS; Temperature 297K |