| SpectraBase Spectrum ID |
1dKsmdyLorf |
| Name |
2,3,7,8,12,13,17,18-Octaethyl-5,10-bis(4-ethynyl-phenyl)-porphyrin |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C52H54N4 |
| InChI |
InChI=1S/C52H54N4/c1-11-31-21-25-33(26-22-31)47-49-39(17-7)37(15-5)45(54-49)29-43-35(13-3)36(14-4)44(53-43)30-46-38(16-6)40(18-8)50(55-46)48(34-27-23-32(12-2)24-28-34)52-42(20-10)41(19-9)51(47)56-52/h1-2,21-30,54-55H,13-20H2,3-10H3/b43-29-,44-30-,45-29-,46-30-,49-47-,50-48-,51-47-,52-48- |
| InChIKey |
IXNXXDAXZCMJEH-QPPBZBRESA-N |
| Molecular Weight |
735.032 g/mol |
| SMILES |
[nH]1c2c(c(c1cc1nc(cc3[nH]c(c(c4nc(c2-c2ccc(C#C)cc2)c(c4CC)CC)-c2ccc(C#C)cc2)c(c3CC)CC)c(c1CC)CC)CC)CC |
| SPLASH |
splash10-001r-0001000900-3fc9f08bfae1daf45769 |
| Source of Spectrum |
F-66-3519-41 |
| Wiley ID |
1683148 |
