| SpectraBase Spectrum ID |
3YzZn7iMqOa |
| Name |
(4-Chlorophenyl) [4-(4-Methoxyphenyl)-2-methylbut-3-yn-2-yl]Sulfide |
| Appearance |
Orange oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H17ClOS |
| InChI |
InChI=1S/C18H17ClOS/c1-18(2,21-17-10-6-15(19)7-11-17)13-12-14-4-8-16(20-3)9-5-14/h4-11H,1-3H3 |
| InChIKey |
CMYPUXUCYNXVQX-UHFFFAOYSA-N |
| Instrument Name |
Agilent 6890N/5973/Thermo 1300GC-ISQ 7017 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.joc.1c00333 |
| Molecular Weight |
316.846 g/mol |
| Reported Formula |
C18H17ClOS |
| SMILES |
C(C#Cc1ccc(cc1)OC)(Sc1ccc(cc1)Cl)(C)C |
| SPLASH |
splash10-00di-0900000000-167d36908efd85588c74 |
| Source of Spectrum |
JOC-86-7084-4jc |
| Thin-Layer Chromatography |
Rf = 0.38 (hexane/EtOAc, 20:1) |
| Wiley ID |
1867718 |
![(4-Chlorophenyl) [4-(4-Methoxyphenyl)-2-methylbut-3-yn-2-yl]Sulfide](/api/spectrum/3YzZn7iMqOa/structure.png?h=300&w=458 "(4-Chlorophenyl) [4-(4-Methoxyphenyl)-2-methylbut-3-yn-2-yl]Sulfide")
