![2,9,19,26-Tetraoxa-14,14,31,31-tetramethylpentacyclo[30.2.2.2(10,13).2(15,18).2(27,30)] diatetraconta-1(34),10,12,15,17,27,29,32,35,37,39,41-dodecaene-4,6,21,23tetrayne](/api/spectrum/AWOjxY1VvY8/structure.png?h=300&w=458 "2,9,19,26-Tetraoxa-14,14,31,31-tetramethylpentacyclo[30.2.2.2(10,13).2(15,18).2(27,30)] diatetraconta-1(34),10,12,15,17,27,29,32,35,37,39,41-dodecaene-4,6,21,23tetrayne")
| SpectraBase Compound ID | G31YAdtf2Fg |
|---|---|
| InChI | InChI=1S/C42H36O4/c1-41(2)33-13-21-37(22-14-33)43-29-9-5-7-11-31-45-39-25-17-35(18-26-39)42(3,4)36-19-27-40(28-20-36)46-32-12-8-6-10-30-44-38-23-15-34(41)16-24-38/h13-28H,29-32H2,1-4H3 |
| InChIKey | VBFSRYBBMLEHSF-UHFFFAOYSA-N |
| Mol Weight | 604.7 g/mol |
| Molecular Formula | C42H36O4 |
| Exact Mass | 604.26136 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AWOjxY1VvY8 |
|---|---|
| Name | 2,9,19,26-Tetraoxa-14,14,31,31-tetramethylpentacyclo[30.2.2.2(10,13).2(15,18).2(27,30)] diatetraconta-1(34),10,12,15,17,27,29,32,35,37,39,41-dodecaene-4,6,21,23tetrayne |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C42H36O4 |
| InChI | InChI=1S/C42H36O4/c1-41(2)33-13-21-37(22-14-33)43-29-9-5-7-11-31-45-39-25-17-35(18-26-39)42(3,4)36-19-27-40(28-20-36)46-32-12-8-6-10-30-44-38-23-15-34(41)16-24-38/h13-28H,29-32H2,1-4H3 |
| InChIKey | VBFSRYBBMLEHSF-UHFFFAOYSA-N |
| Molecular Weight | 604.746 g/mol |
| SMILES | C1(c2ccc(OCC#CC#CCOc3ccc(C(c4ccc(OCC#CC#CCOc5ccc1cc5)cc4)(C)C)cc3)cc2)(C)C |
| SPLASH | splash10-01p9-6790001000-4fdffe2511adf627e123 |
| Source of Spectrum | Y1-43B-1502-4a |
| Wiley ID | 1744297 |