SpectraBase Spectrum ID |
DY5h7eXQ2Em |
Name |
(4-Methoxyphenyl) (2-Methyl-4-phenylbut-3-yn-2-yl) Sulfide |
Appearance |
Pale yellow oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H18OS |
InChI |
InChI=1S/C18H18OS/c1-18(2,14-13-15-7-5-4-6-8-15)20-17-11-9-16(19-3)10-12-17/h4-12H,1-3H3 |
InChIKey |
DTEOUTVABJLDEZ-UHFFFAOYSA-N |
Instrument Name |
Agilent 6890N/5973/Thermo 1300GC-ISQ 7000 |
Ionization Type |
EI |
Literature Reference DOI |
10.1021/acs.joc.1c00333 |
Molecular Weight |
282.401 g/mol |
Reported Formula |
C18H18OS |
SMILES |
C(C#Cc1ccccc1)(Sc1ccc(cc1)OC)(C)C |
SPLASH |
splash10-004i-2910000000-5697d4fe3c43087c4962 |
Source of Spectrum |
JOC-86-7083-4ab |
Thin-Layer Chromatography |
Rf = 0.12 (hexane/ EtOAc, 50:1) |
Wiley ID |
1867699 |