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AB-PINACA pentanoic acid metabolite

View entire compound with spectra: 1 FTIR, and 1 Raman

AB-PINACA pentanoic acid metabolite
SpectraBase Compound ID 1ACPvoBZhYy
InChI InChI=1S/C18H24N4O4/c1-11(2)15(17(19)25)20-18(26)16-12-7-3-4-8-13(12)22(21-16)10-6-5-9-14(23)24/h3-4,7-8,11,15H,5-6,9-10H2,1-2H3,(H2,19,25)(H,20,26)(H,23,24)
InChIKey QNEBIXFSJOHXCK-UHFFFAOYSA-N
Mol Weight 360.41 g/mol
Molecular Formula C18H24N4O4
Exact Mass 360.179755 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID 3awwhdjCefZ
Name AB-PINACA pentanoic acid metabolite
Source of Sample Cayman Chemical Company
Catalog Number 15051
Lot Number 0476282-8
Accessory DurasamplIR II
CAS Registry Number 1879029-93-2
Classification synthetic cannabinoid that has been identified in illegal herbal products
Copyright Copyright © 2014-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24N4O4
InChI InChI=1S/C18H24N4O4/c1-11(2)15(17(19)25)20-18(26)16-12-7-3-4-8-13(12)22(21-16)10-6-5-9-14(23)24/h3-4,7-8,11,15H,5-6,9-10H2,1-2H3,(H2,19,25)(H,20,26)(H,23,24)
InChIKey QNEBIXFSJOHXCK-UHFFFAOYSA-N
Instrument Name Bio-Rad FTS
Sample Description crystalline solid
Source of Spectrum Forensic Spectral Research
Synonyms 3-[[[1-(Aminocarbonyl)-2-methylpropyl]amino]carbonyl]-1H-indazole-1-pentanoic acid​
Technique ATR-Neat (DuraSamplIR II)