| SpectraBase Spectrum ID |
EC2rEwmZWyo |
| Name |
5-[4'-( 10"-Bromodecyloxy)phenyl-]-10",15'-20"-tris(4-methylphenyl)porphyrin |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C57H55BrN4O |
| InChI |
InChI=1S/C57H55BrN4O/c1-38-12-18-41(19-13-38)54-46-28-30-48(59-46)55(42-20-14-39(2)15-21-42)50-32-34-52(61-50)57(44-24-26-45(27-25-44)63-37-11-9-7-5-4-6-8-10-36-58)53-35-33-51(62-53)56(49-31-29-47(54)60-49)43-22-16-40(3)17-23-43/h12-35,59,62H,4-11,36-37H2,1-3H3/b54-46-,54-47-,55-48-,55-50-,56-49-,56-51-,57-52-,57-53- |
| InChIKey |
MRWKCFFDWPAZCT-RXISYZRNSA-N |
| Molecular Weight |
891.998 g/mol |
| SMILES |
[nH]1c2ccc1c(c1nc(c(c3[nH]c(c(c4nc(c2-c2ccc(cc2)C)cc4)-c2ccc(cc2)C)cc3)-c2ccc(cc2)OCCCCCCCCCCBr)cc1)-c1ccc(cc1)C |
| SPLASH |
splash10-0006-0000000090-54810fbe02e2768a2cfe |
| Source of Spectrum |
K-129-1079-1 |
| Synonyms |
2-{4-[(10-bromodecyl)oxy]phenyl}-7,12,17-tris(4-methylphenyl)-21,22,23,24-tetraazapentacyclo[16.2.1.1(3,6).1(8,11).1(13,16)]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaene |
| Wiley ID |
1417974 |
![5-[4'-( 10"-Bromodecyloxy)phenyl-]-10",15'-20"-tris(4-methylphenyl)porphyrin](/api/spectrum/EC2rEwmZWyo/structure.png?h=300&w=458 "5-[4'-( 10\"-Bromodecyloxy)phenyl-]-10\",15'-20\"-tris(4-methylphenyl)porphyrin")
