5-fluoro AB-PINACA N-(4-hydroxypentyl) metabolite

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Systematic / IUPAC Name: N-(1-Amino-3-methyl-1-oxobutan-2-yl)-1-(5-fluoro-4-hydroxypentyl)indazole-3-carboxamide

ID: Reference8476

Other Names: N-(1-Amino-3-methyl-1-oxobutan-2-yl)-1-(5-fluoro-4-hydroxypentyl)-1H-indazole-3-carboxamide

Formula: C18H25FN4O3

Class: Drugs of Abuse/Illegal Drugs Sports Doping Drugs

Spectral Data

5-fluoro AB-PINACA N-(4-hydroxypentyl) metabolite mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion with FAIMS
No. of Spectral Trees 2
No. of Spectra 3205
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6, MS7
Ionization Methods NSI
Analyzers FT
Last Modification 1/8/2019 8:07:23 AM
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Identificators

InChI InChI=1S/C18H25FN4O3/c1-11(2)15(17(20)25)21-18(26)16-13-7-3-4-8-14(13)23(22-16)9-5-6-12(24)10-19/h3-4,7-8,11-12,15,24H,5-6,9-10H2,1-2H3,(H2,20,25)(H,21,26)
InChI Key IEYDKWLGOBQFKU-UHFFFAOYSA-N
Canonical SMILES CC(C)C(C(=O)N)NC(=O)C1=NN(C2=CC=CC=C21)CCCC(CF)O
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Other Names N-(1-Amino-3-methyl-1-oxobutan-2-yl)-1-(5-fluoro-4-hydroxypentyl)-1H-indazole-3-carboxamide

In Other Databases

Cayman 15052
PubChem 118964467
ChemSpider 29763743