SpectraBase Spectrum ID |
5beocOFkxeQ |
Name |
5,5'-di(Benzyloxycarbonyl)-3,3'-diethyl-4,4'-dimethyl-2,2'-dipyrrylmethane |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
498.251857579 u |
Formula |
C31H34N2O4 |
InChI |
InChI=1S/C31H34N2O4/c1-5-24-20(3)28(30(34)36-18-22-13-9-7-10-14-22)32-26(24)17-27-25(6-2)21(4)29(33-27)31(35)37-19-23-15-11-8-12-16-23/h7-16,32-33H,5-6,17-19H2,1-4H3 |
InChIKey |
PEMZHJXFRVUICU-UHFFFAOYSA-N |
Molecular Weight |
498.623 g/mol |
SMILES |
C=1(NC(CC=2NC(C(OCC3=CC=CC=C3)=O)=C(C2CC)C)=C(C1C)CC)C(OCC1=CC=CC=C1)=O |