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ADB-BINACA
SpectraBase Compound ID DTyJ1pgjqm3
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)
InChIKey IUFIUAWRCUVUCQ-UHFFFAOYSA-N
Mol Weight 364.45 g/mol
Molecular Formula C21H24N4O2
Exact Mass 364.189926 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 3dIU7Wjiy9m
Name ADB-BINACA
Source of Sample Cayman Chemical Company
Catalog Number 18757
Lot Number 0481751-1
Cell Type Capillary tube
Compound Type Pure
Copyright Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24N4O2
IUPAC Name N-(1-Amino-3,3-dimethyl-1-oxobutan-2-yl)-1-benzyl-1H-indazole-3-carboxamide
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)
InChIKey IUFIUAWRCUVUCQ-UHFFFAOYSA-N
Raman Corrections Referenced to internal white light source; 180 degree backscatter
Raman Laser Power 597 mW
Raman Laser Source Nd:YAG
SMILES N(C(c1c2ccccc2[n](n1)Cc1ccccc1)=O)C(C(N)=O)C(C)(C)C
Scans Performed 2048
Source of Spectrum Forensic Spectral Research
Technique FT-Raman