![2,16-Dioxoheptacyclo[36.4.0.0(3,8).0(10,15).0(17,22).0(24,29).0(31,36)]dotetraconta-1(38),3(8),4,6,10(15),11,13,17(22),18,20,24(29),25,27,31(36),32,34,39,41-octadecaene](/api/spectrum/INYixw2VQnQ/structure.png?h=300&w=458 "2,16-Dioxoheptacyclo[36.4.0.0(3,8).0(10,15).0(17,22).0(24,29).0(31,36)]dotetraconta-1(38),3(8),4,6,10(15),11,13,17(22),18,20,24(29),25,27,31(36),32,34,39,41-octadecaene")
| SpectraBase Compound ID | LujTKUpn5FS |
|---|---|
| InChI | InChI=1S/C42H32O2/c43-41-37-21-9-5-17-33(37)26-31-15-3-1-13-29(31)25-30-14-2-4-16-32(30)27-34-18-6-10-22-38(34)42(44)40-24-12-8-20-36(40)28-35-19-7-11-23-39(35)41/h1-24H,25-28H2 |
| InChIKey | YZGXMABSTVMMRK-UHFFFAOYSA-N |
| Mol Weight | 568.7 g/mol |
| Molecular Formula | C42H32O2 |
| Exact Mass | 568.24023 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | INYixw2VQnQ |
|---|---|
| Name | 2,16-Dioxoheptacyclo[36.4.0.0(3,8).0(10,15).0(17,22).0(24,29).0(31,36)]dotetraconta-1(38),3(8),4,6,10(15),11,13,17(22),18,20,24(29),25,27,31(36),32,34,39,41-octadecaene |
| Alternate Name(s) | 25,30-dihydrohexabenzo[a,d,g,j,m,p]cyclooctadecene-5,15(10H,20H)-dione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C42H32O2 |
| InChI | InChI=1S/C42H32O2/c43-41-37-21-9-5-17-33(37)26-31-15-3-1-13-29(31)25-30-14-2-4-16-32(30)27-34-18-6-10-22-38(34)42(44)40-24-12-8-20-36(40)28-35-19-7-11-23-39(35)41/h1-24H,25-28H2 |
| InChIKey | YZGXMABSTVMMRK-UHFFFAOYSA-N |
| Molecular Weight | 568.716 g/mol |
| SMILES | C1(c2c(Cc3c(C(c4c(cccc4)Cc4c(Cc5c(Cc6c1cccc6)cccc5)cccc4)=O)cccc3)cccc2)=O |
| SPLASH | splash10-014i-0011090000-7caba4ecca20049e40ab |
| Source of Spectrum | J-58-7156-26 |
| Wiley ID | 1407608 |