| SpectraBase Spectrum ID |
53y0pIJJZI |
| Name |
(1S*,4R*,5R)-8-[(Methylthio)thiocarbonyl]oxy-1,3,3-trimethyl-6-ethoxycarbonylbicyclo[2.2.2]oct-5-en-2-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H22O4S2 |
| InChI |
InChI=1S/C16H22O4S2/c1-6-19-12(17)10-7-9-11(20-14(21)22-5)8-16(10,4)13(18)15(9,2)3/h7,9,11H,6,8H2,1-5H3/t9-,11+,16-/m0/s1 |
| InChIKey |
BOJHHMXFWQBXOB-ZXLZKYRFSA-N |
| Molecular Weight |
342.468 g/mol |
| SMILES |
[C@@]12(C(=C[C@@]([C@@](C2)(OC(=S)SC)[H])(C(C1=O)(C)C)[H])C(=O)OCC)C |
| SPLASH |
splash10-0btc-7590000000-a1931771b9aa2ad291d4 |
| Source of Spectrum |
F-69-453-10 |
| Synonyms |
Ethyl 1,5,5-trimethyl-8-{[(methylsulfanyl)carbothioyl]oxy}-6-oxobicyclo[2.2.2]oct-2-ene-2-carboxylate |
| Wiley ID |
1594555 |
![(1S*,4R*,5R)-8-[(Methylthio)thiocarbonyl]oxy-1,3,3-trimethyl-6-ethoxycarbonylbicyclo[2.2.2]oct-5-en-2-one](/api/spectrum/53y0pIJJZI/structure.png?h=300&w=458 "(1S*,4R*,5R)-8-[(Methylthio)thiocarbonyl]oxy-1,3,3-trimethyl-6-ethoxycarbonylbicyclo[2.2.2]oct-5-en-2-one")
