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5-Fluoro-CUMYL-PICA

View entire compound with spectra: 2 FTIR, 1 Raman, and 5 MS (GC)

5-Fluoro-CUMYL-PICA
SpectraBase Compound ID SF4nozSmnU
InChI InChI=1S/C23H27FN2O/c1-23(2,18-11-5-3-6-12-18)25-22(27)20-17-26(16-10-4-9-15-24)21-14-8-7-13-19(20)21/h3,5-8,11-14,17H,4,9-10,15-16H2,1-2H3,(H,25,27)
InChIKey ZJCYQNSYQBCKOD-UHFFFAOYSA-N
Mol Weight 366.48 g/mol
Molecular Formula C23H27FN2O
Exact Mass 366.210742 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID DO6sjK8GwYE
Name 5-Fluoro CUMYL-PICA
Source of Sample Cayman Chemical Company
Catalog Number 17212
Lot Number 0466221-7
CAS Registry Number 1400742-18-8
Classification analog of CUMYL-PICA characterized by the addition of an alkyl-terminal fluorine atom
Copyright Copyright © 2012-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H27FN2O
IUPAC Name 1-(5-Fluoropentyl)-N-(1-methyl-1-phenylethyl)-1H-indole-3-carboxamide
InChI InChI=1S/C23H27FN2O/c1-23(2,18-11-5-3-6-12-18)25-22(27)20-17-26(16-10-4-9-15-24)21-14-8-7-13-19(20)21/h3,5-8,11-14,17H,4,9-10,15-16H2,1-2H3,(H,25,27)
InChIKey ZJCYQNSYQBCKOD-UHFFFAOYSA-N
Instrument Name Bio-Rad FTS
SMILES N(C(c1c2ccccc2[n](c1)CCCCCF)=O)C(c1ccccc1)(C)C
Source of Spectrum Forensic Spectral Research
Synonyms SGT-67
Technique KBr0