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CH-FUBBMPDORA
SpectraBase Compound ID KCgcCBSUhGo
InChI InChI=1S/C20H22BrFN2O2/c1-13-17(21)12-24(11-14-7-9-16(22)10-8-14)20(26)18(13)23-19(25)15-5-3-2-4-6-15/h7-10,12,15H,2-6,11H2,1H3,(H,23,25)
InChIKey CKYYASUICQFJPH-UHFFFAOYSA-N
Mol Weight 421.31 g/mol
Molecular Formula C20H22BrFN2O2
Exact Mass 420.084869 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID 2R3xVGu4sVb
Name CHO-4'Me-5'Br-FUBOXPYRA
Source of Sample Cayman Chemical Company
Catalog Number 37468
Lot Number 0678629-12
Accessory DurasamplIR II
Copyright Copyright © 2019-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 420.084869117 u
Formula C20H22BrFN2O2
InChI InChI=1S/C20H22BrFN2O2/c1-13-17(21)12-24(11-14-7-9-16(22)10-8-14)20(26)18(13)23-19(25)15-5-3-2-4-6-15/h7-10,12,15H,2-6,11H2,1H3,(H,23,25)
InChIKey CKYYASUICQFJPH-UHFFFAOYSA-N
Instrument Name Bio-Rad FTS
Molecular Weight 421.310 g/mol
Purity ≥98%
Resolution 4
SMILES C1(CCCCC1)C(=O)NC=1C(N(C=C(C1C)Br)CC=1C=CC(=CC1)F)=O
Scan Speed (number) 5
Source of Spectrum Forensic Spectral Research
Synonyms N-(5-bromo-1-(4-fluorobenzyl)-4-methyl-2-oxo-1,2-dihydropyridin-3-yl)cyclohexanecarboxamide 6TP CH-FUBBMPDORA
Technique ATR-Neat