![Nonacyclo[27.13.0.0(2,7).0(9,14).0(16,21).0(23,28).0(30,35).0(37,42)]ditetraconta-1(29),2(7),3,5,9(14),10,12,16(21),17,19,23(28),24,26,30(35),31,33,37,42,38,40-nonadecaene](/api/spectrum/Km5cjvVqooN/structure.png?h=300&w=458 "Nonacyclo[27.13.0.0(2,7).0(9,14).0(16,21).0(23,28).0(30,35).0(37,42)]ditetraconta-1(29),2(7),3,5,9(14),10,12,16(21),17,19,23(28),24,26,30(35),31,33,37,42,38,40-nonadecaene")
| SpectraBase Compound ID | 9NJi5z0Hrp5 |
|---|---|
| InChI | InChI=1S/C42H32/c1-3-15-31-26-33-17-5-9-21-37(33)41-39-23-11-7-19-35(39)28-36-20-8-12-24-40(36)42(41)38-22-10-6-18-34(38)27-32-16-4-2-14-30(32)25-29(31)13-1/h1-24H,25-28H2 |
| InChIKey | ZMRLKDKSFFKHMK-UHFFFAOYSA-N |
| Mol Weight | 536.7 g/mol |
| Molecular Formula | C42H32 |
| Exact Mass | 536.250401 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Km5cjvVqooN |
|---|---|
| Name | Nonacyclo[27.13.0.0(2,7).0(9,14).0(16,21).0(23,28).0(30,35).0(37,42)]ditetraconta-1(29),2(7),3,5,9(14),10,12,16(21),17,19,23(28),24,26,30(35),31,33,37,42,38,40-nonadecaene |
| Alternate Name(s) | 5,14,23,28-tetrahydrotetrabenzo[a,e,h,k]dibenzo[3,4:6,7]cyclohepta[1,2-c]cyclotridecene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C42H32 |
| InChI | InChI=1S/C42H32/c1-3-15-31-26-33-17-5-9-21-37(33)41-39-23-11-7-19-35(39)28-36-20-8-12-24-40(36)42(41)38-22-10-6-18-34(38)27-32-16-4-2-14-30(32)25-29(31)13-1/h1-24H,25-28H2 |
| InChIKey | ZMRLKDKSFFKHMK-UHFFFAOYSA-N |
| Molecular Weight | 536.718 g/mol |
| SMILES | C12=C(c3c(Cc4c(cccc4)Cc4c(Cc5c1cccc5)cccc4)cccc3)c1c(cccc1)Cc1c2cccc1 |
| SPLASH | splash10-000i-0000090000-1449dc83fee996763acf |
| Source of Spectrum | J-58-7156-27 |
| Wiley ID | 1404188 |