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4-cyano ADB-BUTINACA
SpectraBase Compound ID FgPCSowQ55H
InChI InChI=1S/C19H25N5O2/c1-19(2,3)16(17(21)25)22-18(26)15-13-9-5-6-10-14(13)24(23-15)12-8-4-7-11-20/h5-6,9-10,16H,4,7-8,12H2,1-3H3,(H2,21,25)(H,22,26)
InChIKey NJHAOEDIIRSZHL-UHFFFAOYSA-N
Mol Weight 355.44 g/mol
Molecular Formula C19H25N5O2
Exact Mass 355.200825 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID IZKH9Q3XFZ1
Name 4-Cyano ADB-BUTINACA
Source of Sample Cayman Chemical Company
Catalog Number 26506
Cell Type Capillary tube
Copyright Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H25N5O2
IUPAC Name N-(1-Amino-3,3-dimethyl-1-oxobutan-2-yl)-1-(4-cyanobutyl)-1H-indazole-3-carboxamide
InChI InChI=1S/C19H25N5O2/c1-19(2,3)16(17(21)25)22-18(26)15-13-9-5-6-10-14(13)24(23-15)12-8-4-7-11-20/h5-6,9-10,16H,4,7-8,12H2,1-3H3,(H2,21,25)(H,22,26)
InChIKey NJHAOEDIIRSZHL-UHFFFAOYSA-N
Molecular Weight 355.442 g/mol
Purity >=98%
Raman Corrections Referenced to internal white light source; 180 degree backscatter
Raman Laser Source Nd:YAG
SMILES N(C(c1n[n](c2c1cccc2)CCCCC#N)=O)C(C(N)=O)C(C)(C)C
Scans Performed 2240
Source of Spectrum Forensic Spectral Research
Synonyms 4CN-ADB-BINACA; 4CN-ADB-BUTINACA
Technique FT-Raman
UV - Neutral Conditions UVmax (nm): 302