![7,8;27,28;29,30;31,32-Tetrabenzo-pentadecacyclo[24.2.2.2(6,9).0(2,13).0(2,25).0(3,11).0(4,24).0(5,10).o(5,22).0(10,20).0(12,19).0(14,18).0(15,25).0(16,23).0(17,21)]dotriacontane](/api/spectrum/CMtq4654MlJ/structure.png?h=300&w=458 "7,8;27,28;29,30;31,32-Tetrabenzo-pentadecacyclo[24.2.2.2(6,9).0(2,13).0(2,25).0(3,11).0(4,24).0(5,10).o(5,22).0(10,20).0(12,19).0(14,18).0(15,25).0(16,23).0(17,21)]dotriacontane")
| SpectraBase Compound ID | BL6wcC02XVo |
|---|---|
| InChI | InChI=1S/C48H36/c1-5-13-21-17(9-1)33-18-10-2-6-14-22(18)35(21)47-39-29-26-25-27-31-40-30(25)38-28(26)32(39)42-44(47)43(41(31)45(33,47)37(27)29)48(40)36-23-15-7-3-11-19(23)34(46(38,42)48)20-12-4-8-16-24(20)36/h1-16,25-44H |
| InChIKey | CROBPWYUNXVQGI-UHFFFAOYSA-N |
| Mol Weight | 612.8 g/mol |
| Molecular Formula | C48H36 |
| Exact Mass | 612.281701 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CMtq4654MlJ |
|---|---|
| Name | 7,8;27,28;29,30;31,32-Tetrabenzo-pentadecacyclo[24.2.2.2(6,9).0(2,13).0(2,25).0(3,11).0(4,24).0(5,10).o(5,22).0(10,20).0(12,19).0(14,18).0(15,25).0(16,23).0(17,21)]dotriacontane |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C48H36 |
| InChI | InChI=1S/C48H36/c1-5-13-21-17(9-1)33-18-10-2-6-14-22(18)35(21)47-39-29-26-25-27-31-40-30(25)38-28(26)32(39)42-44(47)43(41(31)45(33,47)37(27)29)48(40)36-23-15-7-3-11-19(23)34(46(38,42)48)20-12-4-8-16-24(20)36/h1-16,25-44H |
| InChIKey | CROBPWYUNXVQGI-UHFFFAOYSA-N |
| Molecular Weight | 612.816 g/mol |
| SMILES | C123C4(C5C6C7C4C4C1C1C8C9C(C7C48)C6C46C5C2C1C94C1c2ccccc2C6c2ccccc12)C1c2c(C3c3c1cccc3)cccc2 |
| SPLASH | splash10-004i-0900000000-913916b500c580dcb93c |
| Source of Spectrum | QE-8-520-28 |
| Wiley ID | 1557147 |