| SpectraBase Spectrum ID |
6RhGFV6yMhE |
| Name |
1-methyl-3-(pentylsulfonyl)benzene |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
226.102750992 u |
| Formula |
C12H18O2S |
| InChI |
InChI=1S/C12H18O2S/c1-3-4-5-9-15(13,14)12-8-6-7-11(2)10-12/h6-8,10H,3-5,9H2,1-2H3 |
| InChIKey |
QQOKZCPGPTZCEZ-UHFFFAOYSA-N |
| Instrument Name |
Shimazdu QP-5000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201702892 |
| Molecular Weight |
226.334 g/mol |
| Quality |
314 |
| Reported Formula |
C12H18O2S |
| SMILES |
C1(=CC(=CC=C1)C)S(CCCCC)(=O)=O |
| SPLASH |
splash10-052f-9600000000-a622043cdbed713795e0 |
| Source of Spectrum |
QE-23-SM8-5c (DOI: 10.1002/chem.201702892) |
| Thin-Layer Chromatography |
0.3 (Hexane/AcOEt, 4:1) |
| Wiley ID |
1905637 |
