![6,13-Dihydroxy-5,7,12,14-Tetrahydro-5,14[1',2']:7,12[1'',2'']-dibenzenopentacene](/api/spectrum/BXusk4vOk1/structure.png?h=300&w=458 "6,13-Dihydroxy-5,7,12,14-Tetrahydro-5,14[1',2']:7,12[1'',2'']-dibenzenopentacene")
| SpectraBase Compound ID | JU5RNdJv3wB |
|---|---|
| InChI | InChI=1S/C34H22O2/c35-33-29-25-17-9-1-2-10-18(17)26(20-12-4-3-11-19(20)25)30(29)34(36)32-28-23-15-7-5-13-21(23)27(31(32)33)22-14-6-8-16-24(22)28/h1-16,25-28,35-36H/t25-,26+,27-,28+ |
| InChIKey | HPYBKBAZBQZHFU-KMKVIZFGSA-N |
| Mol Weight | 462.5 g/mol |
| Molecular Formula | C34H22O2 |
| Exact Mass | 462.16198 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BXusk4vOk1 |
|---|---|
| Name | 6,13-Dihydroxy-5,7,12,14-Tetrahydro-5,14[1',2']:7,12[1'',2'']-dibenzenopentacene |
| Alternate Name(s) | 6,13-Dihydroxy-5,7,12,14-tetrahydro-5,14[1',2']:7,12[1'',2'']-dibenzenopentacene nonacyclo[14.6.6.6(5,12).0(2,15).0(4,13).0(6,11).0(17,22).0(23,28).0(29,34)]tetratriaconta-2(15),3,6,8,10,13,17,19,21,23,25,27,29,31,33-pentadecaene-3,14-diol |
| CAS Registry Number | 78823-45-7 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C34H22O2 |
| InChI | InChI=1S/C34H22O2/c35-33-29-25-17-9-1-2-10-18(17)26(20-12-4-3-11-19(20)25)30(29)34(36)32-28-23-15-7-5-13-21(23)27(31(32)33)22-14-6-8-16-24(22)28/h1-16,25-28,35-36H/t25-,26+,27-,28+ |
| InChIKey | HPYBKBAZBQZHFU-KMKVIZFGSA-N |
| Molecular Weight | 462.548 g/mol |
| SMILES | Oc1c2c(c(c3c1[C@]1(c4c([C@@]3(c3c1cccc3)[H])cccc4)[H])O)[C@@]1(c3c([C@]2(c2c1cccc2)[H])cccc3)[H] |
| SPLASH | splash10-0ina-0490800000-28e2910ba4e9c4b1e557 |
| Source of Spectrum | J-46-4431-0 |
| Wiley ID | 1391230 |