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AM281
SpectraBase Compound ID 2B5POAVcbL4
InChI InChI=1S/C21H19Cl2IN4O2/c1-13-19(21(29)26-27-8-10-30-11-9-27)25-28(18-7-4-15(22)12-17(18)23)20(13)14-2-5-16(24)6-3-14/h2-7,12H,8-11H2,1H3,(H,26,29)
InChIKey AJFFBPZYXRNAIC-UHFFFAOYSA-N
Mol Weight 557.22 g/mol
Molecular Formula C21H19Cl2IN4O2
Exact Mass 555.992976 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID KMu7O5zsQTf
Name AM281
Source of Sample Cayman Chemical Company
Catalog Number 10006972
Lot Number 0464791-8
CAS Registry Number 202463-68-1
Cell Type Capillary tube
Compound Type Pure
Copyright Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19Cl2IN4O2
IUPAC Name 1-(2,4-Dichlorophenyl)-5-(4-iodophenyl)-4-methyl-N-4-morpholinyl-1H-pyrazole-3-carboxamide
InChI InChI=1S/C21H19Cl2IN4O2/c1-13-19(21(29)26-27-8-10-30-11-9-27)25-28(18-7-4-15(22)12-17(18)23)20(13)14-2-5-16(24)6-3-14/h2-7,12H,8-11H2,1H3,(H,26,29)
InChIKey AJFFBPZYXRNAIC-UHFFFAOYSA-N
Raman Corrections Referenced to internal white light source; 180 degree backscatter
Raman Laser Power 1002 mW
Raman Laser Source Nd:YAG
SMILES N(C(c1n[n](c(c1C)-c1ccc(cc1)I)-c1ccc(cc1Cl)Cl)=O)N1CCOCC1
Scans Performed 2112
Source of Spectrum Forensic Spectral Research
Technique FT-Raman