| SpectraBase Spectrum ID |
EJkekAiGuJA |
| Name |
1,1,3,3-Tetramethyl-6-adamantanyl-7-(bistrifluoromethyl)-5,8-dithia-6-azaspiro[3,4]octane-2-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H27F6NOS2 |
| InChI |
InChI=1S/C21H27F6NOS2/c1-15(2)14(29)16(3,4)19(15)30-18(20(22,23)24,21(25,26)27)28(31-19)17-8-11-5-12(9-17)7-13(6-11)10-17/h11-13H,5-10H2,1-4H3/t11-,12+,13-,17- |
| InChIKey |
SGYUEHHWHBXHEZ-FBBPANFNSA-N |
| Molecular Weight |
487.563 g/mol |
| SMILES |
C12(SC(C(F)(F)F)(C(F)(F)F)N(S2)C23C[C@]4(C[C@@](C3)(C[C@@](C2)(C4)[H])[H])[H])C(C(=O)C1(C)C)(C)C |
| SPLASH |
splash10-000i-0900000000-e51d011bcf85124cdb6a |
| Source of Spectrum |
F-56-4237-11 |
| Wiley ID |
857340 |
![1,1,3,3-Tetramethyl-6-adamantanyl-7-(bistrifluoromethyl)-5,8-dithia-6-azaspiro[3,4]octane-2-one](/api/spectrum/EJkekAiGuJA/structure.png?h=300&w=458 "1,1,3,3-Tetramethyl-6-adamantanyl-7-(bistrifluoromethyl)-5,8-dithia-6-azaspiro[3,4]octane-2-one")
