SpectraBase Spectrum ID |
8VcXKau95Z8 |
Name |
3,5-Pyrazolidinedione, 4-[[5-bromo-2-[2-(2-phenoxyethoxy)ethoxy]phenyl]methylene]-1-phenyl-, (4E)- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
522.079034844 u |
Formula |
C26H23BrN2O5 |
InChI |
InChI=1S/C26H23BrN2O5/c27-20-11-12-24(34-16-14-32-13-15-33-22-9-5-2-6-10-22)19(17-20)18-23-25(30)28-29(26(23)31)21-7-3-1-4-8-21/h1-12,17-18H,13-16H2,(H,28,30)/b23-18+ |
InChIKey |
FVONUUUPEAIIHA-PTGBLXJZSA-N |
Molecular Weight |
523.383 g/mol |
SMILES |
N1N(C(\C(C1=O)=C/C=1C(=CC=C(C1)Br)OCCOCCOC1=CC=CC=C1)=O)C1=CC=CC=C1 |