![1,2:9,10-bis{(9,10)Phenanthreno[2.2]paracyclophane}-1,9-diene](/api/spectrum/C5mucoSCiEh/structure.png?h=300&w=458 "1,2:9,10-bis{(9,10)Phenanthreno[2.2]paracyclophane}-1,9-diene")
| SpectraBase Compound ID | BaANJioL4xf |
|---|---|
| InChI | InChI=1S/C40H24/c1-5-13-33-29(9-1)30-10-2-6-14-34(30)38-26-21-23-28(24-22-26)40-36-16-8-4-12-32(36)31-11-3-7-15-35(31)39(40)27-19-17-25(18-20-27)37(33)38/h1-24H/b37-25-,38-26-,39-27-,40-28- |
| InChIKey | JELOHSKUUATTSF-CZQJZSHPSA-N |
| Mol Weight | 504.6 g/mol |
| Molecular Formula | C40H24 |
| Exact Mass | 504.187801 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | C5mucoSCiEh |
|---|---|
| Name | 1,2:9,10-bis{(9,10)Phenanthreno[2.2]paracyclophane}-1,9-diene |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C40H24 |
| InChI | InChI=1S/C40H24/c1-5-13-33-29(9-1)30-10-2-6-14-34(30)38-26-21-23-28(24-22-26)40-36-16-8-4-12-32(36)31-11-3-7-15-35(31)39(40)27-19-17-25(18-20-27)37(33)38/h1-24H/b37-25-,38-26-,39-27-,40-28- |
| InChIKey | JELOHSKUUATTSF-CZQJZSHPSA-N |
| Molecular Weight | 504.632 g/mol |
| SMILES | c1-2c(c3ccccc3c3c1cccc3)-c1ccc(-c3c4c(cccc4)c4c(c3-c3ccc2cc3)cccc4)cc1 |
| SPLASH | splash10-0udi-0000090000-af80f96d563cafdfad7d |
| Source of Spectrum | K-125-1897-7 |
| Synonyms | nonacyclo[32.2.2.2(16,19).0(2,15).0(3,8).0(9,14).0(20,33).0(21,26).0(27,32)]tetraconta-1(36),2(15),3,5,7,9,11,13,16,18,20(33),21,23,25,27,29,31,34,37,39-icosaene |
| Wiley ID | 1399671 |