| SpectraBase Spectrum ID |
IVqh5Edcws8 |
| Name |
5-(p-Ethynylphenyl)-10,20-diphenylporphyrin |
| Alternate Name(s) |
7-(4-ethynylphenyl)-2,12-diphenyl-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 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C40H26N4 |
| InChI |
InChI=1S/C40H26N4/c1-2-26-13-15-29(16-14-26)40-36-23-21-34(43-36)38(27-9-5-3-6-10-27)32-19-17-30(41-32)25-31-18-20-33(42-31)39(28-11-7-4-8-12-28)35-22-24-37(40)44-35/h1,3-25,41,44H/b30-25-,31-25-,38-32-,38-34-,39-33-,39-35-,40-36-,40-37- |
| InChIKey |
JEEJNFUIYHKFEK-MEWLEOLYSA-N |
| Molecular Weight |
562.676 g/mol |
| SMILES |
[nH]1c2c(c3nc(c(c4ccc(c(c5nc(cc1cc2)cc5)-c1ccccc1)[nH]4)-c1ccc(cc1)C#C)cc3)-c1ccccc1 |
| SPLASH |
splash10-03di-0000090000-bffd16027ef1af54cd85 |
| Source of Spectrum |
K-2001-1035-10 |
| Wiley ID |
1578778 |
