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5-fluoro CUMYL-PeGACLONE
SpectraBase Compound ID BU1LTvktghw
InChI InChI=1S/C25H27FN2O/c1-25(2,19-11-5-3-6-12-19)28-18-15-22-23(24(28)29)20-13-7-8-14-21(20)27(22)17-10-4-9-16-26/h3,5-8,11-15,18H,4,9-10,16-17H2,1-2H3
InChIKey SMRRORRDOWXERZ-UHFFFAOYSA-N
Mol Weight 390.5 g/mol
Molecular Formula C25H27FN2O
Exact Mass 390.210742 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID 1TUPPY6HhbY
Name 5-Fluoro CUMYL-PeGACLONE
Source of Sample Cayman Chemical Company
Catalog Number 25435
Lot Number 0545195-14
Accessory DurasamplIR II
Apodization Function Norton-Beer, medium
CAS Registry Number 2377403-49-9
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Formula C25H27FN2O
IUPAC Name 5-(5-Fluoropentyl)-2,5-dihydro-2-(1-methyl-1-phenylethyl)-1H-pyrido[4,3-b]indol-1-one
InChI InChI=1S/C25H27FN2O/c1-25(2,19-11-5-3-6-12-19)28-18-15-22-23(24(28)29)20-13-7-8-14-21(20)27(22)17-10-4-9-16-26/h3,5-8,11-15,18H,4,9-10,16-17H2,1-2H3
InChIKey SMRRORRDOWXERZ-UHFFFAOYSA-N
Instrument Name Bio-Rad FTS
Molecular Weight 390.502 g/mol
Purity >=98%
SMILES C(N1C=Cc2c(C1=O)c1c([n]2CCCCCF)cccc1)(c1ccccc1)(C)C
Sample Comments ground on diamond with ethanol
Scan Speed (number) 5
Source of Spectrum Forensic Spectral Research
Synonyms 5-Fluoro SGT-151
Technique ATR-Neat
UV - Neutral Conditions UVmax (nm): 245, 314, 328, 352