| SpectraBase Spectrum ID |
CpR46xTjKIM |
| Name |
(4R,5S,9S,10S,11S)-Morel-2-en-1,7-dione 7-ethylenedithioketal |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H24OS2 |
| InChI |
InChI=1S/C17H24OS2/c1-9-7-12(18)14-10(2)11-8-17(19-5-6-20-17)16(3,4)15(14)13(9)11/h7,10-11,13-15H,5-6,8H2,1-4H3/t10-,11-,13+,14-,15-/m0/s1 |
| InChIKey |
ILXWFKWBRLRATJ-OPYWOCCESA-N |
| Instrument Name |
Hewlett-Packard 5989A or Varian Saturn 2000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np030354e |
| Molecular Weight |
308.498 g/mol |
| Optical Rotation |
[a]D = +152 (c = 1.83) |
| Reported Formula |
C17H24OS2 |
| SMILES |
C=1C([C@]2([C@@]3([C@](C1C)([C@@](CC1(C3(C)C)SCCS1)([C@@]2(C)[H])[H])[H])[H])[H])=O |
| SPLASH |
splash10-001i-0790000000-8cd590fc44e3dfea0204 |
| Source of Spectrum |
G4-67-192-6 |
| Wiley ID |
1881660 |
