SpectraBase Spectrum ID |
GAJ88UHM78h |
Name |
R-8507 |
Source of Sample |
Cayman Chemical Company |
Catalog Number |
22479 |
Lot Number |
0513234-1 |
CAS Registry Number |
338773-13-0 |
Cell Type |
Capillary tube |
Compound Type |
Pure |
Copyright |
Copyright © 2015-2024 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 |
Molecular Weight |
348.716 g/mol |
Raman Corrections |
Referenced to internal white light source; 180 degree backscatter |
Raman Laser Power |
1299 mW |
Raman Laser Source |
Nd:YAG |
SMILES |
C(F)(F)(F)c1c2[n](c3c(n1)cccc3)c(nn2)-c1ccc(cc1)Cl |
Scans Performed |
2048 |
Source of Spectrum |
Forensic Spectral Research |
Technique |
FT-Raman |