| SpectraBase Compound ID | 7PqbPwj0nrt |
|---|---|
| InChI | InChI=1S/C19H25BrN4O2/c1-5-6-7-10-24-14-9-8-12(20)11-13(14)15(23-24)18(26)22-16(17(21)25)19(2,3)4/h5,8-9,11,16H,1,6-7,10H2,2-4H3,(H2,21,25)(H,22,26)/t16-/m1/s1 |
| InChIKey | SKMMFULKOGGVOT-MRXNPFEDSA-N |
| Mol Weight | 421.34 g/mol |
| Molecular Formula | C19H25BrN4O2 |
| Exact Mass | 420.116089 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Dn0rSmPb14S |
|---|---|
| Name | ADB-4-en-P-5Br-INACA |
| Classification | Indazolecarboxamide cannabinoid designer drug |
| Copyright | Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass | 420.116089059 u |
| Formula | C19H25BrN4O2 |
| InChI | InChI=1S/C19H25BrN4O2/c1-5-6-7-10-24-14-9-8-12(20)11-13(14)15(23-24)18(26)22-16(17(21)25)19(2,3)4/h5,8-9,11,16H,1,6-7,10H2,2-4H3,(H2,21,25)(H,22,26)/t16-/m1/s1 |
| InChIKey | SKMMFULKOGGVOT-MRXNPFEDSA-N |
| Ionization Type | Electron Ionization (EI) |
| Molecular Weight | 421.339 g/mol |
| Nominal Mass | 420 u |
| Quality | 957 |
| Retention Index | 3150 |
| SMILES | NC([C@@](NC(C=1C=2C(N(N1)CCCC=C)=CC=C(C2)Br)=O)(C(C)(C)C)[H])=O |
| SPLASH | splash10-002f-4394000000-40c5ac1227fecf1e1c7e |
| Source of Spectrum | DigiLab GmbH (C) 2024 |
| Synonyms | N-((2S)-1-amino-3,3-dimethyl-1-oxobutan-2-yl)-5-bromo-1-(pent-4-en-1-yl)-1H-indazole-3-carboxamide |
| Technique | GC/MS |
| Wiley ID | DD2024_033686 |