| SpectraBase Compound ID | ABa10jPuQ9n |
|---|---|
| InChI | InChI=1S/C22H34N4O2Si/c1-8-9-12-15-26-17-14-11-10-13-16(17)18(25-26)21(27)24-19(22(2,3)4)20(23)28-29(5,6)7/h8,10-11,13-14,19,23H,1,9,12,15H2,2-7H3,(H,24,27)/b23-20+ |
| InChIKey | IBHDBBVHGQLUBP-BSYVCWPDSA-N |
| Mol Weight | 414.6 g/mol |
| Molecular Formula | C22H34N4O2Si |
| Exact Mass | 414.245103 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8Gxak1L11ou |
|---|---|
| Name | ADB-4en-PINACA TMS |
| Classification | Indazole cannabinoid designer drug derivative |
| Copyright | Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass | 414.245102884 u |
| Formula | C22H34N4O2Si |
| InChI | InChI=1S/C22H34N4O2Si/c1-8-9-12-15-26-17-14-11-10-13-16(17)18(25-26)21(27)24-19(22(2,3)4)20(23)28-29(5,6)7/h8,10-11,13-14,19,23H,1,9,12,15H2,2-7H3,(H,24,27)/b23-20+ |
| InChIKey | IBHDBBVHGQLUBP-BSYVCWPDSA-N |
| Ionization Type | Electron Ionization (EI) |
| Molecular Weight | 414.625 g/mol |
| Nominal Mass | 414 u |
| Quality | 992 |
| Retention Index | 3235 |
| SMILES | C(NC(C=1C=2C(N(N1)CCCC=C)=CC=CC2)=O)(C(O[Si](C)(C)C)=N)C(C)(C)C |
| SPLASH | splash10-01ot-3390000000-a6f368652efc170857b4 |
| Sample Comments | TMS position uncertain |
| Source of Spectrum | DigiLab GmbH (C) 2024 |
| Synonyms | N-(1-Amino-3,3-dimethyl-1-oxobutan-2-yl)-1-(pent-4-en-1-yl)-N-(trimethylsilyl)-1H-indazole-3-carboxamide |
| Technique | GC/MS |
| Wiley ID | DD2024_030964 |