Systematic / IUPAC Name: N-[(2S,3S)-1-Amino-3-methyl-1-oxo-2-pentanyl]-2-(5-fluoropentyl)-2H-indazole-3-carboxamide
ID: Reference6239
Other Names:
N-(1-Amino-3S-methyl-1-oxopentan-2S-yl)-2-(5-fluoropentyl)-2H-indazole-3-carboxamide;
2H-Indazole-3-carboxamide, N-[(1S,2S)-1-(aminocarbonyl)-2-methylbutyl]-2-(5-fluoropentyl)-
Formula: C19H27FN4O2
Class: Drugs of Abuse/Illegal Drugs
5-Fluoro-2-ADB-PINACA isomer 2 mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Q Exactive Plus Orbitrap |
No. of Spectral Trees | 2 |
No. of Spectra | 234 |
Tandem Spectra | MS1, MS2 |
Ionization Methods | ESI |
Analyzers | FT |
Last Modification | 1/24/2017 8:54:47 AM |
InChI | InChI=1S/C19H27FN4O2/c1-3-13(2)16(18(21)25)22-19(26)17-14-9-5-6-10-15(14)23-24(17)12-8-4-7-11-20/h5-6,9-10,13,16H,3-4,7-8,11-12H2,1-2H3,(H2,21,25)(H,22,26)/t13-,16-/m0/s1 |
InChI Key | CIXZTODJNNGQFI-BBRMVZONSA-N |
Canonical SMILES | CC[C@H](C)[C@@H](C(=O)N)NC(=O)c1c2ccccc2nn1CCCCCF |
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Other Names |
N-(1-Amino-3S-methyl-1-oxopentan-2S-yl)-2-(5-fluoropentyl)-2H-indazole-3-carboxamide; 2H-Indazole-3-carboxamide, N-[(1S,2S)-1-(aminocarbonyl)-2-methylbutyl]-2-(5-fluoropentyl)- |
ChemSpider | 34975845 |