Systematic / IUPAC Name: N-(1-Amino-3,3-dimethyl-1-oxo-2-butanyl)-1-benzyl-1H-indazole-3-carboxamide
ID: Reference7322
Other Names: N-(1-Amino-3,3-dimethyl-1-oxobutan-2-yl)-1-benzyl-1H-indazole-3-carboxamide
Formula: C21H24N4O2
Class: Drugs of Abuse/Illegal Drugs
ADB-BINACA 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 | 2/5/2018 8:50:14 AM |
InChI | InChI=1S/C21H24N4O2/c1-21(2,3)18(19(22)26)23-20(27)17-15-11-7-8-12-16(15)25(24-17)13-14-9-5-4-6-10-14/h4-12,18H,13H2,1-3H3,(H2,22,26)(H,23,27) |
InChI Key | IUFIUAWRCUVUCQ-UHFFFAOYSA-N |
Canonical SMILES | CC(C)(C)C(C(=O)N)NC(=O)C1=NN(C2=CC=CC=C21)CC3=CC=CC=C3 |
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Other Names | N-(1-Amino-3,3-dimethyl-1-oxobutan-2-yl)-1-benzyl-1H-indazole-3-carboxamide |