| SpectraBase Spectrum ID |
3rSCc03Tovj |
| Name |
Pentacyclo[18.2.2.23,6.29,12.214,17]triaconta-3,5,9,11,14,16,20,22,23,25,27,29-dodecaen-2-one |
| Alternate Name(s) |
Pentacyclo[18.2.2.2(3,6).2(9,12).2(14,17)]triaconta-1(22),3,5,9,11,14,16,20,23,25,27,29-dodecaen-2-one
[2.1.2.1]paracyclophane-9-one |
| CAS Registry Number |
114067-24-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H26O |
| InChI |
InChI=1S/C30H26O/c31-30-28-17-13-24(14-18-28)3-1-22-5-9-26(10-6-22)21-27-11-7-23(8-12-27)2-4-25-15-19-29(30)20-16-25/h5-20H,1-4,21H2 |
| InChIKey |
HQWBTRNPGNZFGA-UHFFFAOYSA-N |
| Molecular Weight |
402.537 g/mol |
| SMILES |
C1(c2ccc(cc2)CCc2ccc(cc2)Cc2ccc(CCc3ccc1cc3)cc2)=O |
| SPLASH |
splash10-0udi-0400900000-8ca938cbb84b8dfbd1e2 |
| Source of Spectrum |
F-43-3211-5 |
| Wiley ID |
1370750 |
![Pentacyclo[18.2.2.23,6.29,12.214,17]triaconta-3,5,9,11,14,16,20,22,23,25,27,29-dodecaen-2-one](/api/spectrum/3rSCc03Tovj/structure.png?h=300&w=458 "Pentacyclo[18.2.2.23,6.29,12.214,17]triaconta-3,5,9,11,14,16,20,22,23,25,27,29-dodecaen-2-one")
