Phenanthrenophane](/api/spectrum/GZFhQjYFRZ0/structure.png?h=300&w=458 "[4.4](3,6)Phenanthrenophane")
| SpectraBase Compound ID | 9vUMNdUMVfu |
|---|---|
| InChI | InChI=1S/C36H32/c1-2-6-26-10-14-30-19-20-32-16-12-28(24-36(32)34(30)22-26)8-4-3-7-27-11-15-31-18-17-29-13-9-25(5-1)21-33(29)35(31)23-27/h9-24H,1-8H2 |
| InChIKey | IGWAVCSHJKSKMK-UHFFFAOYSA-N |
| Mol Weight | 464.7 g/mol |
| Molecular Formula | C36H32 |
| Exact Mass | 464.250401 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GZFhQjYFRZ0 |
|---|---|
| Name | [4.4](3,6)Phenanthrenophane |
| Alternate Name(s) | Heptacyclo[18.8.4.4(6,15).0(9,35).0(12,34).0(23,31).0(26,30)]hexatriaconta-1(29),6,8,10,12,14,20(32),21,23,25,27,30,33,35-tetradecaene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C36H32 |
| InChI | InChI=1S/C36H32/c1-2-6-26-10-14-30-19-20-32-16-12-28(24-36(32)34(30)22-26)8-4-3-7-27-11-15-31-18-17-29-13-9-25(5-1)21-33(29)35(31)23-27/h9-24H,1-8H2 |
| InChIKey | IGWAVCSHJKSKMK-UHFFFAOYSA-N |
| Molecular Weight | 464.652 g/mol |
| SMILES | c12c3c4ccc(c3)CCCCc3cc5c6cc(CCCCc(c1)ccc2cc4)ccc6ccc5cc3 |
| SPLASH | splash10-03xr-0150900000-f3c8295659bfc45c6358 |
| Source of Spectrum | C-118-1012-5 |
| Wiley ID | 759471 |