| SpectraBase Spectrum ID |
7BZEWsnJp3Z |
| Name |
(E)-2-cyano-N-(3-cyano-4-(furan-2-yl)-5,6-dimethylpyridin-2-yl)-3-(1,3-diphenyl-1H-pyrazol-5-yl)acrylamide |
| Appearance |
Orange crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C31H22N6O2 |
| InChI |
InChI=1S/C31H22N6O2/c1-20-21(2)34-30(26(19-33)29(20)28-14-9-15-39-28)35-31(38)23(18-32)16-25-17-27(22-10-5-3-6-11-22)36-37(25)24-12-7-4-8-13-24/h3-17H,1-2H3,(H,34,35,38)/b23-16+ |
| InChIKey |
HQJXIDAOFYOQBH-XQNSMLJCSA-N |
| Instrument Name |
Kratos MS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.2414 |
| Molecular Weight |
510.557 g/mol |
| SMILES |
N(c1c(c(c(c(n1)C)C)-c1ccco1)C#N)C(\C(C#N)=C\c1[n](nc(c1)-c1ccccc1)-c1ccccc1)=O |
| SPLASH |
splash10-0a5a-1695720000-62cd87d5cb89bfb16b60 |
| Source of Spectrum |
Y-53-1249-29 |
| Wiley ID |
1876536 |
