| SpectraBase Spectrum ID |
7TiYdBqaLjf |
| Name |
4-(3-Oxo-3-phenylprop-1-yn-1-yl)benzonitrile |
| Appearance |
Colorless solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H9NO |
| InChI |
InChI=1S/C16H9NO/c17-12-14-8-6-13(7-9-14)10-11-16(18)15-4-2-1-3-5-15/h1-9H |
| InChIKey |
MNJOORIWNLGABD-UHFFFAOYSA-N |
| Instrument Name |
Finnigan MAT TSQ 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3762/bjoc.15.262 |
| Molecular Weight |
231.254 g/mol |
| SMILES |
c1cc(ccc1)C(=O)C#Cc1ccc(cc1)C#N |
| SPLASH |
splash10-0udi-0390000000-099e03656737b2fb01af |
| Source of Spectrum |
BJO-15-SM9-3i |
| Thin-Layer Chromatography |
Rf = 0.26 (n-hexane/EtOAc, 5:1) |
| Wiley ID |
1840964 |
