SpectraBase Spectrum ID |
DtA0HP5Z2fq |
Name |
1-Methyl-4-[(3-phenyl-2-propyn-1-yl)thio]benzene |
Appearance |
Brown oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C16H14S |
InChI |
InChI=1S/C16H14S/c1-14-9-11-16(12-10-14)17-13-5-8-15-6-3-2-4-7-15/h2-4,6-7,9-12H,13H2,1H3 |
InChIKey |
IJQQVWZPXYXYIF-UHFFFAOYSA-N |
Instrument Name |
Agilent 6890N/5973/Thermo 1300GC-ISQ 7024 |
Ionization Type |
EI |
Literature Reference DOI |
10.1021/acs.joc.1c00333 |
Molecular Weight |
238.348 g/mol |
SMILES |
C(C#Cc1ccccc1)Sc1ccc(cc1)C |
SPLASH |
splash10-014i-1910000000-e4a8b67c3380da8f7169 |
Source of Spectrum |
JOC-86-7085-5 |
Thin-Layer Chromatography |
Rf = 0.17 (hexane) |
Wiley ID |
1867722 |