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R-8507

View entire compound with spectra: 2 FTIR, and 1 Raman

R-8507
SpectraBase Compound ID KsdMwOblRdm
InChI InChI=1S/C16H8ClF3N4/c17-10-7-5-9(6-8-10)14-22-23-15-13(16(18,19)20)21-11-3-1-2-4-12(11)24(14)15/h1-8H
InChIKey PEOTYDSXVIEYAM-UHFFFAOYSA-N
Mol Weight 348.72 g/mol
Molecular Formula C16H8ClF3N4
Exact Mass 348.038958 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID E4Z1qWolYzi
Name R-8507
Source of Sample Cayman Chemical Company
Catalog Number 22479
Lot Number 0513234-1
Accessory DurasamplIR II
Apodization Function Norton-Beer, medium
CAS Registry Number 338773-13-0
Copyright Copyright © 2019-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H8ClF3N4
IUPAC Name 1-(4-Chlorophenyl)-4-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]quinoxaline
InChI InChI=1S/C16H8ClF3N4/c17-10-7-5-9(6-8-10)14-22-23-15-13(16(18,19)20)21-11-3-1-2-4-12(11)24(14)15/h1-8H
InChIKey PEOTYDSXVIEYAM-UHFFFAOYSA-N
Instrument Name Bio-Rad FTS
SMILES C(F)(F)(F)c1c2[n](c3c(n1)cccc3)c(nn2)-c1ccc(cc1)Cl
Source of Spectrum Forensic Spectral Research
Technique ATR-Neat