| SpectraBase Compound ID | IWDha0A2sfg |
|---|---|
| InChI | InChI=1S/C54H40O2/c1-33-45-34(2)49-50(54(40-27-15-8-16-28-40)44-32-20-19-31-43(44)53(49,56-54)39-25-13-7-14-26-39)36(4)46(45)35(3)48-47(33)51(37-21-9-5-10-22-37)41-29-17-18-30-42(41)52(48,55-51)38-23-11-6-12-24-38/h5-32H,1-4H3 |
| InChIKey | WRJFGRVJKUNGJO-UHFFFAOYSA-N |
| Mol Weight | 720.9 g/mol |
| Molecular Formula | C54H40O2 |
| Exact Mass | 720.302831 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EIj4ZsA3xOn |
|---|---|
| Name | 5,16:8,13-Diepoxyhexacene, 5,8,13,16-tetrahydro-6,7,14,15-tetramethyl-5,8,13,16-tetraphenyl- |
| Alternate Name(s) | 3,5,16,18-tetramethyl-1,7,14,20-tetraphenyl-27,28-dioxaoctacyclo[18.6.1.1(7,14).0(2,19).0(4,17).0(6,15).0(8,13).0(21,26)]octacosa-2,4(17),5,8,10,12,15,18,21,23,25-undecaene 6,7,14,15-Tetramethyl-5,8,13,15-tetraphenyl-5,16:8,13-bisepoxy(di(pheno[a]cyclohexo)[4,5-a:4',5'-d]naphthalene) |
| CAS Registry Number | 115695-59-5 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C54H40O2 |
| InChI | InChI=1S/C54H40O2/c1-33-45-34(2)49-50(54(40-27-15-8-16-28-40)44-32-20-19-31-43(44)53(49,56-54)39-25-13-7-14-26-39)36(4)46(45)35(3)48-47(33)51(37-21-9-5-10-22-37)41-29-17-18-30-42(41)52(48,55-51)38-23-11-6-12-24-38/h5-32H,1-4H3 |
| InChIKey | WRJFGRVJKUNGJO-UHFFFAOYSA-N |
| Molecular Weight | 720.912 g/mol |
| SMILES | C12(c3c(c(C)c4c(c3C)c(c3C5(OC(c3c4C)(c3ccccc53)c3ccccc3)c3ccccc3)C)C(O1)(c1ccccc1)c1c2cccc1)c1ccccc1 |
| SPLASH | splash10-0a4i-2900000000-64a1dc4bfcaab93e5427 |
| Source of Spectrum | F-43-5216-28 |
| Wiley ID | 1415647 |