![8,11,14,27,30,33-Hexaoxa-39,40,41,42-tetraazapentacyclo[33.3.1.12,6.116,20.121,25]dotetraconta-1(39),2,4,6(42),16,18,20(41),21,23,25(40),35,37-dodecaene](/api/spectrum/LwrJqxjVehM/structure.png?h=300&w=458 "8,11,14,27,30,33-Hexaoxa-39,40,41,42-tetraazapentacyclo[33.3.1.12,6.116,20.121,25]dotetraconta-1(39),2,4,6(42),16,18,20(41),21,23,25(40),35,37-dodecaene")
| SpectraBase Compound ID | LkVsPlNDrGM |
|---|---|
| InChI | InChI=1S/C32H36N4O6/c1-5-25-21-39-17-13-37-14-19-41-23-27-7-3-11-31(35-27)32-12-4-8-28(36-32)24-42-20-16-38-15-18-40-22-26-6-2-10-30(34-26)29(9-1)33-25/h1-12H,13-24H2 |
| InChIKey | AKBAREPSTRNYST-UHFFFAOYSA-N |
| Mol Weight | 572.7 g/mol |
| Molecular Formula | C32H36N4O6 |
| Exact Mass | 572.263485 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LwrJqxjVehM |
|---|---|
| Name | 8,11,14,27,30,33-Hexaoxa-39,40,41,42-tetraazapentacyclo[33.3.1.12,6.116,20.121,25]dotetraconta-1(39),2,4,6(42),16,18,20(41),21,23,25(40),35,37-dodecaene |
| CAS Registry Number | 123074-61-3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C32H36N4O6 |
| InChI | InChI=1S/C32H36N4O6/c1-5-25-21-39-17-13-37-14-19-41-23-27-7-3-11-31(35-27)32-12-4-8-28(36-32)24-42-20-16-38-15-18-40-22-26-6-2-10-30(34-26)29(9-1)33-25/h1-12H,13-24H2 |
| InChIKey | AKBAREPSTRNYST-UHFFFAOYSA-N |
| Molecular Weight | 572.662 g/mol |
| SMILES | c1-2nc(COCCOCCOCc3nc(-c4cccc(COCCOCCOCc5nc2ccc5)n4)ccc3)ccc1 |
| SPLASH | splash10-000t-0910000000-7da7a4eae292e7bc91bb |
| Source of Spectrum | J-54-5109-7 |
| Synonyms | 8,11,14,27,30,33-hexaoxa-39,40,41,42-tetraazapentacyclo[33.3.1.1(2,6).1(16,20).1(21,25)]dotetraconta-1(39),2(42),3,5,16(41),17,19,21(40),22,24,35,37-dodecaene 8,11,14,27,30,33-Hexaoxa-39,40,41,42-tetraazapentacyclo[33.3.1.1(2,6).1(16,20).1(21,25)]dotetraconta-1-(39),2,4,6, (40),16,18,20(41),21,23,25(42),35,37-dodecaene |
| Wiley ID | 1407864 |