SpectraBase Spectrum ID |
Jg5nAaLMqW7 |
Name |
7-Benzoyl-6-chloro-3-pivaloyl-8-(pyrrolidin-1-yl)imidazo[1,2-b]pyridazine-2-carbonitrile |
Appearance |
Yellow solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
435.146202666 u |
Formula |
C23H22ClN5O2 |
GC Column |
HP 5 (10 m x 0.25 mm, film thickness 0.25 micrometer) |
InChI |
InChI=1S/C23H22ClN5O2/c1-23(2,3)20(31)17-15(13-25)26-22-18(28-11-7-8-12-28)16(21(24)27-29(17)22)19(30)14-9-5-4-6-10-14/h4-6,9-10H,7-8,11-12H2,1-3H3 |
InChIKey |
MCGPMDQLXXBGLO-UHFFFAOYSA-N |
Instrument Name |
Finnigan MAT 95Q or Finnigan MAT 90 |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/chem.202200733 |
Molecular Weight |
435.915 g/mol |
Quality |
217 |
Reported Formula |
C23H22ClN5O2 |
SMILES |
C1(=CC=CC=C1)C(=O)C1=C(C=2N(N=C1Cl)C(=C(N2)C#N)C(C(C)(C)C)=O)N1CCCC1 |
SPLASH |
splash10-0pb9-6501900000-1922011cc0531436ad32 |
Source of Spectrum |
QE-28-SM73-55b (DOI: 10.1002/chem.202200733) |
Wiley ID |
1900466 |