| SpectraBase Compound ID | 35KJBt255JL |
|---|---|
| InChI | InChI=1S/C19H26FN3O2/c1-13(2)17(18(21)24)22-19(25)15-12-23(11-7-3-6-10-20)16-9-5-4-8-14(15)16/h4-5,8-9,12-13,17H,3,6-7,10-11H2,1-2H3,(H2,21,24)(H,22,25)/t17-/m1/s1 |
| InChIKey | GQYZBLMAONPUNX-QGZVFWFLSA-N |
| Mol Weight | 347.43 g/mol |
| Molecular Formula | C19H26FN3O2 |
| Exact Mass | 347.200905 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | InTJaUWf4Sr |
|---|---|
| Name | 5-Fluoro-ABICA |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C19H26FN3O2 |
| InChI | InChI=1S/C19H26FN3O2/c1-13(2)17(18(21)24)22-19(25)15-12-23(11-7-3-6-10-20)16-9-5-4-8-14(15)16/h4-5,8-9,12-13,17H,3,6-7,10-11H2,1-2H3,(H2,21,24)(H,22,25)/t17-/m1/s1 |
| InChIKey | GQYZBLMAONPUNX-QGZVFWFLSA-N |
| Molecular Weight | 347.434 g/mol |
| SMILES | N(C(c1c2ccccc2[n](c1)CCCCCF)=O)[C@@](C(N)=O)(C(C)C)[H] |
| SPLASH | splash10-001i-1490000000-72c12f241457b1354183 |
| Source of Spectrum | SWG-33-4243-0 |
| Synonyms | (S)-N-(1-amino-3-methyl-1-oxobutan-2-yl)-1-(5-fluoropentyl)-1H-indole-3-carboxamide 5F-ABICA (R)-N-(1-amino-3-methyl-1-oxobutan-2-yl)-1-(5-fluoropentyl)-1H-indole-3-carboxamide |
| Wiley ID | 1810865 |