| SpectraBase Spectrum ID |
CjOOfqSEXjl |
| Name |
(2-Methyloct-3-yn-2-yl) (p-Tolyl) Sulfide |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H22S |
| InChI |
InChI=1S/C16H22S/c1-5-6-7-8-13-16(3,4)17-15-11-9-14(2)10-12-15/h9-12H,5-7H2,1-4H3 |
| InChIKey |
PHKCOZMXGGRCBY-UHFFFAOYSA-N |
| Instrument Name |
Agilent 6890N/5973/Thermo 1300GC-ISQ 7021 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.joc.1c00333 |
| Molecular Weight |
246.412 g/mol |
| Reported Formula |
C16H22S |
| SMILES |
C(C#CCCCC)(Sc1ccc(cc1)C)(C)C |
| SPLASH |
splash10-00dj-0790000000-10bce2663aeacce22b13 |
| Source of Spectrum |
JOC-86-7085-4la |
| Thin-Layer Chromatography |
Rf = 0.33 (hexane/CH2Cl2, 50:1) |
| Wiley ID |
1867721 |
