| SpectraBase Spectrum ID |
Jii1OW9wxSn |
| Name |
2-((2E,6E)-8-(benzyloxy)-6-methylocta-2,6-dien-2-yl)-2-(3-methylbut-2-en-1-yl)-1,3-dithiane |
| Carrier Gas |
Helium |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
416.220758126 u |
| Formula |
C25H36OS2 |
| GC Oven Program |
Oven temp 320 oC |
| InChI |
InChI=1S/C25H36OS2/c1-21(2)14-16-25(27-18-9-19-28-25)23(4)11-8-10-22(3)15-17-26-20-24-12-6-5-7-13-24/h5-7,11-15H,8-10,16-20H2,1-4H3/b22-15+,23-11+ |
| InChIKey |
RDPCWYAQWSHPCO-SYHLSMFNSA-N |
| Inlet Type |
split or splitless injector |
| Instrument Name |
Agilent HP 7890B GC-5977A inert mass detector |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202117273 |
| Molecular Weight |
416.682 g/mol |
| Quality |
449 |
| Reported Formula |
C25H36OS2 |
| SMILES |
C1(\C(=C\CC\C(C)=C\COCC=2C=CC=CC2)C)(SCCCS1)CC=C(C)C |
| SPLASH |
splash10-0006-9422000000-5761bd117bf371ae6332 |
| Source of Spectrum |
ACI-61-SM139-S12 (DOI: 10.1002/anie.202117273) |
| Thin-Layer Chromatography |
0.30 (cyclohexane/ethyl acetate, 20:1) |
| Wiley ID |
1897549 |
