| SpectraBase Spectrum ID |
JtcAPsWmcgT |
| Name |
3-(4-(2,4,4-trimethylpentan-2-yl)phenoxy)propane-1-thiol |
| Appearance |
Colourless liquid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H28OS |
| InChI |
InChI=1S/C17H28OS/c1-16(2,3)13-17(4,5)14-7-9-15(10-8-14)18-11-6-12-19/h7-10,19H,6,11-13H2,1-5H3 |
| InChIKey |
PKIGVFPNIADACO-UHFFFAOYSA-N |
| Instrument Name |
Finnigan Trace DSQ or Finnigan Trace GC Ultra |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3762/bjoc.10.61 |
| Molecular Weight |
280.470 g/mol |
| SMILES |
SCCCOc1ccc(cc1)C(CC(C)(C)C)(C)C |
| SPLASH |
splash10-0a4r-1690000000-99290912afe1258c6514 |
| Source of Spectrum |
BJO-10-SM10-6b |
| Thin-Layer Chromatography |
Rf = 0.61 (ethylacetate/n-hexane, 1:9) |
| Wiley ID |
1854145 |
