| SpectraBase Spectrum ID |
9ZcFdR7AMkG |
| Name |
3-((2-(2-Phenylprop-1-en-1-yl)phenyl)ethynyl)thiophene |
| Appearance |
Brown solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
300.097271689 u |
| Formula |
C21H16S |
| GC Column |
HP-5MS |
| InChI |
InChI=1S/C21H16S/c1-17(19-7-3-2-4-8-19)15-21-10-6-5-9-20(21)12-11-18-13-14-22-16-18/h2-10,13-16H,1H3 |
| InChIKey |
UBRFCPLZPAIWQZ-UHFFFAOYSA-N |
| Instrument Name |
Agilent 6890N-5973 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201405789 |
| Molecular Weight |
300.419 g/mol |
| SMILES |
C1=CC=CC(=C1C=C(C=1C=CC=CC1)C)C#CC=1C=CSC1 |
| SPLASH |
splash10-0udr-0093000000-ae499560f6048e8bfefa |
| Sample Comments |
Major isomer, dr = ~1.5:1 |
| Source of Spectrum |
QE-21-SM9-6d (DOI: 10.1002/chem.201405789) |
| Thin-Layer Chromatography |
0.45 (hexane/EtOAc, 10:1) |
| Wiley ID |
1907715 |
