| SpectraBase Compound ID | CDTt3217oqU |
|---|---|
| InChI | InChI=1S/C21H33FN4O2Si/c1-15(2)18(20(23)28-29(3,4)5)24-21(27)19-16-11-7-8-12-17(16)26(25-19)14-10-6-9-13-22/h7-8,11-12,15,18,23H,6,9-10,13-14H2,1-5H3,(H,24,27)/b23-20- |
| InChIKey | IIKXSPPKJVHLNX-ATJXCDBQSA-N |
| Mol Weight | 420.6 g/mol |
| Molecular Formula | C21H33FN4O2Si |
| Exact Mass | 420.235681 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GXkQ7GoKJMW |
|---|---|
| Name | 5F-AB-PINACA TMS |
| Classification | Indazole cannabinoid designer drug derivative |
| Copyright | Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass | 420.235681015 u |
| Formula | C21H33FN4O2Si |
| InChI | InChI=1S/C21H33FN4O2Si/c1-15(2)18(20(23)28-29(3,4)5)24-21(27)19-16-11-7-8-12-17(16)26(25-19)14-10-6-9-13-22/h7-8,11-12,15,18,23H,6,9-10,13-14H2,1-5H3,(H,24,27)/b23-20- |
| InChIKey | IIKXSPPKJVHLNX-ATJXCDBQSA-N |
| Ionization Type | Electron Ionization (EI) |
| Molecular Weight | 420.604 g/mol |
| Nominal Mass | 420 u |
| Quality | 992 |
| Retention Index | 3340 |
| SMILES | C=1(C=2C(N(N1)CCCCCF)=CC=CC2)C(NC(C(O[Si](C)(C)C)=N)C(C)C)=O |
| SPLASH | splash10-0089-8695000000-3036d96aa01048cb1974 |
| Sample Comments | TMS position uncertain |
| Source of Spectrum | DigiLab GmbH (C) 2024 |
| Synonyms | trimethylsilyl (1Z)-2-(((1-(5-fluoropentyl)-1H-indazol-3-yl)carbonyl)amino)-3-methylbutanimidate |
| Technique | GC/MS |
| Wiley ID | DD2024_018744 |