SpectraBase Spectrum ID |
1nptixDzWnY |
Name |
cis-3,11-dithiatricyclo[11.2.2.1(5,9)]octadeca-1(15),13,16-triene |
Alternate Name(s) |
(5R,9S)-3,11-dithiatricyclo[11.2.2.1(5,9)]octadeca-1(15),13,16-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/c1-2-15-8-16(3-1)12-18-10-14-6-4-13(5-7-14)9-17-11-15/h4-7,15-16H,1-3,8-12H2/t15-,16+ |
InChIKey |
POCAMENCLHVQSD-IYBDPMFKSA-N |
Molecular Weight |
278.472 g/mol |
SMILES |
C1SC[C@@]2(C[C@](CSCc3ccc1cc3)(CCC2)[H])[H] |
SPLASH |
splash10-0udi-0930000000-c8b3097b0a45464ef66b |
Source of Spectrum |
KC-0-1727-11 |
Wiley ID |
828470 |