| SpectraBase Spectrum ID |
EjU6JP0DGGX |
| Name |
3-Cyano-4-(2-cyanoethyl)-5-isopropyl-6-(4-nitrophenyl)-4,5-dihydro-2-pyrazine-carboxamide |
| CAS Registry Number |
71871-38-0 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H18N6O3 |
| InChI |
InChI=1S/C18H18N6O3/c1-11(2)17-15(12-4-6-13(7-5-12)24(26)27)22-16(18(21)25)14(10-20)23(17)9-3-8-19/h4-7,11,17H,3,9H2,1-2H3,(H2,21,25) |
| InChIKey |
HRKHRSNZIORHIX-UHFFFAOYSA-N |
| Molecular Weight |
366.381 g/mol |
| SMILES |
NC(C1=C(N(CCC#N)C(C(=N1)c1ccc(N(=O)=O)cc1)C(C)C)C#N)=O |
| SPLASH |
splash10-00di-0009000000-a1630d9497fa78d05058 |
| Source of Spectrum |
J-44-4876-0 |
| Wiley ID |
1351786 |
