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4-Cyano-CUMYL-BUTINACA

View entire compound with spectra: 3 FTIR, and 5 MS (GC)

4-Cyano-CUMYL-BUTINACA
SpectraBase Compound ID 8bYwjD8De2H
InChI InChI=1S/C22H24N4O/c1-22(2,17-11-5-3-6-12-17)24-21(27)20-18-13-7-8-14-19(18)26(25-20)16-10-4-9-15-23/h3,5-8,11-14H,4,9-10,16H2,1-2H3,(H,24,27)
InChIKey JGTSOWOPISVAHG-UHFFFAOYSA-N
Mol Weight 360.46 g/mol
Molecular Formula C22H24N4O
Exact Mass 360.195011 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID 9S3nBfBi9mn
Name 4-Cyano CUMYL BUTINACA
Source of Sample Cayman Chemical Company
Catalog Number 20194
Lot Number 0490444-3
Accessory DurasamplIR II
Acronyms 4-CN CUMYL-BINAVA; CUMYL-4CN-BINACA; CUMYL-CB-PINACA; CUMYL-CYBINACA
CAS Registry Number 1631074-54-8
Copyright Copyright © 2019-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24N4O
IUPAC Name 1-(4-Cyanobutyl)-N-(1-methyl-1-phenylethyl)-1H-indazole-3-carboxamide
InChI InChI=1S/C22H24N4O/c1-22(2,17-11-5-3-6-12-17)24-21(27)20-18-13-7-8-14-19(18)26(25-20)16-10-4-9-15-23/h3,5-8,11-14H,4,9-10,16H2,1-2H3,(H,24,27)
InChIKey JGTSOWOPISVAHG-UHFFFAOYSA-N
Instrument Name Bio-Rad FTS
SMILES N(C(c1c2ccccc2[n](n1)CCCCC#N)=O)C(c1ccccc1)(C)C
Scan Speed (number) 5
Source of Spectrum Forensic Spectral Research
Synonyms SGT-78
Technique ATR-Neat