SpectraBase Spectrum ID |
BXZhFWBlYY7 |
Name |
Morpholine, 4,4'-[1-(4-bromophenyl)-4,5-dihydro-2-phenyl-1H-imidazole-4,5-diyl]bi S- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
470.131739123 u |
Formula |
C23H27BrN4O2 |
InChI |
InChI=1S/C23H27BrN4O2/c24-19-6-8-20(9-7-19)28-21(18-4-2-1-3-5-18)25-22(26-10-14-29-15-11-26)23(28)27-12-16-30-17-13-27/h1-9,22-23H,10-17H2 |
InChIKey |
DPDUORDPJDKEKV-UHFFFAOYSA-N |
Molecular Weight |
471.399 g/mol |
SMILES |
C=1(N(C(C(N1)N1CCOCC1)N1CCOCC1)C=1C=CC(=CC1)Br)C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.893117 |