| SpectraBase Spectrum ID |
4VVqdGJ5QsG |
| Name |
trans-3,11-dithiatricyclo[11.3.1.1(5,9)]octadeca-1(17),13,15-triene |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H22S2 |
| InChI |
InChI=1S/C16H22S2/c1-3-13-7-14(4-1)10-18-12-16-6-2-5-15(8-16)11-17-9-13/h1,3-4,7,15-16H,2,5-6,8-12H2/t15-,16-/m0/s1 |
| InChIKey |
XPSVAGZVPJIJRZ-HOTGVXAUSA-N |
| Molecular Weight |
278.472 g/mol |
| SMILES |
C1SC[C@@]2(C[C@@](CSCc3cc1ccc3)(CCC2)[H])[H] |
| SPLASH |
splash10-0udi-0950000000-cde6fcdf786c21c4b367 |
| Source of Spectrum |
KC-0-1728-16 |
| Synonyms |
(5S,9S)-3,11-dithiatricyclo[11.3.1.1(5,9)]octadeca-1(17),13,15-triene |
| Wiley ID |
828465 |
![trans-3,11-dithiatricyclo[11.3.1.1(5,9)]octadeca-1(17),13,15-triene](/api/spectrum/4VVqdGJ5QsG/structure.png?h=300&w=458 "trans-3,11-dithiatricyclo[11.3.1.1(5,9)]octadeca-1(17),13,15-triene")
