| SpectraBase Spectrum ID |
AbHHT4vyLzX |
| Name |
Heptacyclo[13.13.9.1(3,27).1(6,10).1(13,17).1(20,24).1(31,35)]dotetraconta-1,3(39),4,6,8,10(42),11,13,15,17(41),18,20,22,24(40),25,27,29,31,33,35(38),36-heneicosaene |
| CAS Registry Number |
84914-99-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C42H30 |
| InChI |
InChI=1S/C42H30/c1-4-31-10-16-37-25-39-18-12-33-6-2-7-34(23-33)13-19-40-26-38(17-11-32(5-1)22-31)28-42(30-40)21-15-36-9-3-8-35(24-36)14-20-41(27-37)29-39/h1-30H/b16-10-,17-11-,18-12-,19-13-,20-14-,21-15- |
| InChIKey |
ZILSDQYBCJKDDF-APGUFNECSA-N |
| Molecular Weight |
534.702 g/mol |
| SMILES |
c12\C=C/c3cc4\C=C/c5cc(\C=C/c6cc(\C=C/c(c2)ccc1)cc(\C=C/c1cc(\C=C/c(c3)c4)ccc1)c6)ccc5 |
| SPLASH |
splash10-001r-0000090000-64bca8271813322b1f1a |
| Source of Spectrum |
SB-36-666-0 |
| Synonyms |
Heptacyclo[13.13.9.1(3,27).1(6,10).1(13,17).1(20,24).1(31,35)]dotetraconta-1,3(39),4,6(42),7,9,11,13(41),14,16,18,20(40),21,23,25,27,29,31(38),32,34,36-henicosaene
[2(6)]-(1,3,4)(2)-(1,3)(3)bicyclophanehexaene |
| Wiley ID |
1403918 |
![Heptacyclo[13.13.9.1(3,27).1(6,10).1(13,17).1(20,24).1(31,35)]dotetraconta-1,3(39),4,6,8,10(42),11,13,15,17(41),18,20,22,24(40),25,27,29,31,33,35(38),36-heneicosaene](/api/spectrum/AbHHT4vyLzX/structure.png?h=300&w=458 "Heptacyclo[13.13.9.1(3,27).1(6,10).1(13,17).1(20,24).1(31,35)]dotetraconta-1,3(39),4,6,8,10(42),11,13,15,17(41),18,20,22,24(40),25,27,29,31,33,35(38),36-heneicosaene")
