SpectraBase Spectrum ID |
a3SPl55ikZ |
Name |
AM281 |
Source of Sample |
Cayman Chemical Company |
Catalog Number |
10006972 |
Lot Number |
0521294-27 |
Accessory |
DurasamplIR II |
CAS Registry Number |
202463-68-1 |
Copyright |
Copyright © 2019-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
555.992976266 u |
Formula |
C21H19Cl2IN4O2 |
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 |
Instrument Name |
Bio-Rad FTS |
Molecular Weight |
557.219 g/mol |
Purity |
≥98% |
Resolution |
4 |
SMILES |
C1(=NN(C(=C1C)C=1C=CC(=CC1)I)C=1C(=CC(=CC1)Cl)Cl)C(=O)NN1CCOCC1 |
Scan Speed (number) |
5 |
Source of Spectrum |
Forensic Spectral Research |
Synonyms |
1-(2,4-dichlorophenyl)-5-(4-iodophenyl)-4-methyl-N-4-morpholinyl-1H-pyrazole-3-carboxamide |
Technique |
ATR-Neat |