| SpectraBase Spectrum ID |
Hm66sBqjEkx |
| Name |
2,15,27-Trithia-[3.3.3](1,3)-Adamantanophane-2,2,15,15,27,27-hexaoxide |
| Alternate Name(s) |
3,13,23-trithiadecacyclo[23.5.1.1(1,27).1(5,9).1(5,11).1(7,11).1(15,19).1(15,21).1(17,21).1(25,29)]nonatriacontane 3,3,13,13,23,23-hexaoxide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C36H54O6S3 |
| InChI |
InChI=1S/C36H54O6S3/c37-43(38)19-31-4-25-1-26(5-31)7-32(6-25,16-31)20-44(39,40)22-34-10-29-3-30(11-34)15-36(14-29,18-34)24-45(41,42)23-35-12-27-2-28(13-35)9-33(8-27,17-35)21-43/h25-30H,1-24H2/t25-,26+,27-,28+,29-,30+,31+,32-,33+,34+,35-,36- |
| InChIKey |
DNBPUFIXLVDMPL-HYMVMMJESA-N |
| Molecular Weight |
679.002 g/mol |
| SMILES |
C1S(C[C@]23C[C@]4(CS(C[C@]56C[C@]7(C[C@@](CS(C[C@@]89C[C@]11C[C@@](C8)(C[C@](C1)(C9)[H])[H])(=O)=O)(C6)C[C@@](C5)(C7)[H])[H])(=O)=O)C[C@](C2)(C[C@](C3)(C4)[H])[H])(=O)=O |
| SPLASH |
splash10-03di-0900035000-ea646a51b451fd522669 |
| Source of Spectrum |
K-127-1155-14 |
| Wiley ID |
1414264 |
-Adamantanophane-2,2,15,15,27,27-hexaoxide](/api/spectrum/Hm66sBqjEkx/structure.png?h=300&w=458 "2,15,27-Trithia-[3.3.3](1,3)-Adamantanophane-2,2,15,15,27,27-hexaoxide")
