SpectraBase Spectrum ID |
F3Jlk0vHq0O |
Name |
1,4-Benzenediacetonitrile, .alpha.,.alpha.'-bis[[4-[[2-(acetyloxy)ethyl]methylamino]phenyl]methylene]- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
562.258005587 u |
Formula |
C34H34N4O4 |
InChI |
InChI=1S/C34H34N4O4/c1-25(39)41-19-17-37(3)33-13-5-27(6-14-33)21-31(23-35)29-9-11-30(12-10-29)32(24-36)22-28-7-15-34(16-8-28)38(4)18-20-42-26(2)40/h5-16,21-22H,17-20H2,1-4H3/b31-21+,32-22+ |
InChIKey |
FXCNSEMKOWIPOF-RWRHWQIFSA-N |
Molecular Weight |
562.670 g/mol |
SMILES |
CN(CCOC(C)=O)C1=CC=C(\C=C/(C#N)C2=CC=C(C=C2)\C(=C\C2=CC=C(C=C2)N(C)CCOC(C)=O)C#N)C=C1 |