| SpectraBase Spectrum ID |
4SZG04y8vMR |
| Name |
I-191 |
| Source of Sample |
Cayman Chemical Company |
| Catalog Number |
37553 |
| Lot Number |
0687444-1 |
| Accessory |
DurasamplIR II |
| CAS Registry Number |
1690172-25-8 |
| Copyright |
Copyright © 2019-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
423.207053258 u |
| Formula |
C23H26FN5O2 |
| InChI |
InChI=1S/C23H26FN5O2/c1-22(2,3)16-12-17(14-6-8-15(24)9-7-14)27-29-13-18(26-19(16)29)20(30)28-11-10-25-21(31)23(28,4)5/h6-9,12-13H,10-11H2,1-5H3,(H,25,31) |
| InChIKey |
DTASTQAQBOZSRR-UHFFFAOYSA-N |
| Instrument Name |
Bio-Rad FTS |
| Molecular Weight |
423.492 g/mol |
| Purity |
≥98% |
| Resolution |
4 |
| SMILES |
C1(NCCN(C1(C)C)C(=O)C=1N=C2C(=CC(=NN2C1)C=1C=CC(=CC1)F)C(C)(C)C)=O |
| Scan Speed (number) |
5 |
| Source of Spectrum |
Forensic Spectral Research |
| Synonyms |
4-[[8-(1,1-dimethylethyl)-6-(4-fluorophenyl)imidazo[1,2-b]pyridazin-2-yl]carbonyl]-3,3-dimethyl-2-piperazinone |
| Technique |
ATR-Neat |
