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ADB-BUTINACA
SpectraBase Compound ID AtZDbFY6bHd
InChI InChI=1S/C18H26N4O2/c1-5-6-11-22-13-10-8-7-9-12(13)14(21-22)17(24)20-15(16(19)23)18(2,3)4/h7-10,15H,5-6,11H2,1-4H3,(H2,19,23)(H,20,24)/t15-/m1/s1
InChIKey GPWADXHYJAZPAX-OAHLLOKOSA-N
Mol Weight 330.43 g/mol
Molecular Formula C18H26N4O2
Exact Mass 330.205576 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID AnGhWFkjEbP
Name ADB-BUTINACA
Source of Sample Cayman Chemical Company
Catalog Number 29350
Lot Number 0603838-8
Accessory DurasamplIR II
Apodization Function Norton-Beer, medium
CAS Registry Number 2682867-55-4
Copyright Copyright © 2019-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26N4O2
IUPAC Name N-[(1S)-1-(Aminocarbonyl)-2,2-dimethylpropyl]-1-butyl-1H-indazole-3-carboxamide
InChI InChI=1S/C18H26N4O2/c1-5-6-11-22-13-10-8-7-9-12(13)14(21-22)17(24)20-15(16(19)23)18(2,3)4/h7-10,15H,5-6,11H2,1-4H3,(H2,19,23)(H,20,24)/t15-/m1/s1
InChIKey GPWADXHYJAZPAX-OAHLLOKOSA-N
Instrument Name Bio-Rad FTS
Molecular Weight 330.432 g/mol
Purity >=98%
SMILES N(C(c1n[n](c2c1cccc2)CCCC)=O)[C@](C(N)=O)(C(C)(C)C)[H]
Scan Speed (number) 5
Source of Spectrum Forensic Spectral Research
Technique ATR-Neat
UV - Neutral Conditions UVmax (nm): 303