| SpectraBase Spectrum ID |
AsTrCsYeYQ3 |
| Name |
10,15,20-tris[3",5"-di(t-butyl)phenyl]-5-(4'-formylphenyl)porphyrine |
| CAS Registry Number |
124856-08-2 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C69H78N4O |
| InChI |
InChI=1S/C69H78N4O/c1-64(2,3)46-31-43(32-47(37-46)65(4,5)6)61-54-25-23-52(70-54)60(42-21-19-41(40-74)20-22-42)53-24-26-55(71-53)62(44-33-48(66(7,8)9)38-49(34-44)67(10,11)12)57-28-30-59(73-57)63(58-29-27-56(61)72-58)45-35-50(68(13,14)15)39-51(36-45)69(16,17)18/h19-40,70,73H,1-18H3/b60-52-,60-53-,61-54-,61-56-,62-55-,62-57-,63-58-,63-59- |
| InChIKey |
XYJSRSTWOJHYON-SWPMMZLJSA-N |
| Molecular Weight |
979.410 g/mol |
| SMILES |
[nH]1c2ccc1c(c1nc(c(c3[nH]c(c(c4nc(c2-c2cc(C(C)(C)C)cc(c2)C(C)(C)C)cc4)-c2cc(C(C)(C)C)cc(c2)C(C)(C)C)cc3)-c2cc(C(C)(C)C)cc(c2)C(C)(C)C)cc1)-c1ccc(C=O)cc1 |
| SPLASH |
splash10-004i-0000000009-595cebcecfdfca3c15d3 |
| Source of Spectrum |
K-123-1355-4 |
| Synonyms |
4-[7,12,17-tris(3,5-di-tert-butylphenyl)-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-undecaen-2-yl]benzaldehyde |
| Wiley ID |
1418332 |
![10,15,20-tris[3",5"-di(t-butyl)phenyl]-5-(4'-formylphenyl)porphyrine](/api/spectrum/AsTrCsYeYQ3/structure.png?h=300&w=458 "10,15,20-tris[3\",5\"-di(t-butyl)phenyl]-5-(4'-formylphenyl)porphyrine")
