| SpectraBase Spectrum ID |
1A05EyMW8ZR |
| Name |
21H,23H-Porphine-2,?-dimethanol, hexaethyl-.alpha.,.alpha.'-dimethyl-, dibenzoate (ester) |
| CAS Registry Number |
59942-58-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C50H54N4O4 |
| InChI |
InChI=1S/C50H54N4O4/c1-7-33-35(9-3)43-28-45-37(11-5)39(23-25-57-49(55)31-19-15-13-16-20-31)47(53-45)30-48-40(24-26-58-50(56)32-21-17-14-18-22-32)38(12-6)46(54-48)29-44-36(10-4)34(8-2)42(52-44)27-41(33)51-43/h13-22,27-30,51,54H,7-12,23-26H2,1-6H3/b41-27-,42-27-,43-28-,44-29-,45-28-,46-29-,47-30-,48-30- |
| InChIKey |
OZVBKQGVZWDQHL-LVVPRXDESA-N |
| Molecular Weight |
775.006 g/mol |
| SMILES |
[nH]1c2c(c(c1cc1nc(cc3[nH]c(cc4nc(c2)c(c4CCOC(=O)c2ccccc2)CC)c(c3CC)CCOC(=O)c2ccccc2)c(c1CC)CC)CC)CC |
| SPLASH |
splash10-0a4i-4900000000-067bbd84da0ffffc6633 |
| Source of Spectrum |
KC-1976-799-0 |
| Synonyms |
2-[20-[2-(benzoyloxy)ethyl]-5,9,10,14,15,19-hexaethyl-21,22,23,24-tetraazapentacyclo[16.2.1.1(3,6).1(8,11).1(13,16)]tetracosa-1(20),2,4,6(24),7,9,11,13(22),14,16,18-undecaen-4-yl]ethyl benzoate
Bis-(1-benzoyloxyethyl)hexaethylporphyrin |
| Wiley ID |
1416791 |
