Systematic / IUPAC Name: N-[(2S,3S)-1-Amino-3-methyl-1-oxopentan-2-yl]-1-(5-fluoropentyl)-1H-indazole-3-carboxamide
ID: Reference5894
Other Names:
Formula: C19H27FN4O2
Class: Drugs of Abuse/Illegal Drugs
5-Fluoro 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 | 1 |
No. of Spectra | 119 |
Tandem Spectra | MS1, MS2 |
Ionization Methods | ESI |
Analyzers | FT |
Last Modification | 11/3/2016 2:16:22 PM |
InChI | 1S/C19H27FN4O2/c1-3-13(2)16(18(21)25)22-19(26)17-14-9-5-6-10-15(14)24(23-17)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 | BGRYUHNKCCAZCH-BBRMVZONSA-N |
Canonical SMILES | O=C(N[C@H](C(N)=O)[C@H](CC)C)C1=NN(CCCCCF)C2=C1C=CC=C2 |
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