AB-FUBINACA 3-fluorobenzyl isomer
8482
Reference
AB-FUBINACA 3-fluorobenzyl isomer Structure
Systematic / IUPAC Name: N-[(2S)-1-Amino-3-methyl-1-oxobutan-2-yl]-1-[(3-fluorophenyl)methyl]indazole-3-carboxamide
ID: Reference8482
Other Names: Nα-[1-(3-Fluorobenzyl)-1H-indazole-3-ylcarbonyl]-L-valinamide
Formula: C20H21FN4O2
Class: Drugs of Abuse/Illegal Drugs Sports Doping Drugs
Spectral Data
AB-FUBINACA 3-fluorobenzyl isomer mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Orbitrap Fusion with FAIMS |
| No. of Spectral Trees | 2 |
| No. of Spectra | 1873 |
| Tandem Spectra | MS1, MS2, MS3, MS4, MS5, MS6, MS7 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 12/18/2018 1:21:52 PM |
Identificators
| InChI | InChI=1S/C20H21FN4O2/c1-12(2)17(19(22)26)23-20(27)18-15-8-3-4-9-16(15)25(24-18)11-13-6-5-7-14(21)10-13/h3-10,12,17H,11H2,1-2H3,(H2,22,26)(H,23,27)/t17-/m0/s1 |
| InChI Key | PDYYWSOYXNOKBK-KRWDZBQOSA-N |
| Canonical SMILES | CC(C)C(C(=O)N)NC(=O)C1=NN(C2=CC=CC=C21)CC3=CC(=CC=C3)F |
| CAS | 1185282192 |
| Splash | |
| Other Names | Nα-[1-(3-Fluorobenzyl)-1H-indazole-3-ylcarbonyl]-L-valinamide |