| SpectraBase Spectrum ID |
2YUaaENE5zb |
| Name |
1-(2,3-Dimethylbut-1-en-1-yl)-2-(3-phenylprop-1-yn-1-yl)benzene |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
274.172150708 u |
| Formula |
C21H22 |
| GC Column |
HP-5MS |
| InChI |
InChI=1S/C21H22/c1-17(2)18(3)16-21-14-8-7-13-20(21)15-9-12-19-10-5-4-6-11-19/h4-8,10-11,13-14,16-17H,12H2,1-3H3 |
| InChIKey |
IYPRCXVVAGREDF-UHFFFAOYSA-N |
| Instrument Name |
Agilent 6890N-5973 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201405789 |
| Molecular Weight |
274.407 g/mol |
| SMILES |
C1=CC=CC(=C1C=C(C(C)C)C)C#CCC1=CC=CC=C1 |
| SPLASH |
splash10-0159-0090000000-6778b47565b8c7f6d393 |
| Sample Comments |
Minor isomer, dr = ~4:1 |
| Source of Spectrum |
QE-21-SM11-6i (DOI: 10.1002/chem.201405789) |
| Thin-Layer Chromatography |
0.34 (hexane) |
| Wiley ID |
1907723 |
