| SpectraBase Spectrum ID |
61QAldMiKpk |
| Name |
4-((3-Isobutyrylphenyl)ethynyl)benzonitrile |
| Appearance |
Yellowish solid |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H15NO |
| InChI |
InChI=1S/C19H15NO/c1-14(2)19(21)18-5-3-4-16(12-18)9-6-15-7-10-17(13-20)11-8-15/h3-5,7-8,10-12,14H,1-2H3 |
| InChIKey |
XZPMRZMNCBHELD-UHFFFAOYSA-N |
| Instrument Name |
Hewlett-Packard 6890 or 5890 Series II |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201704400 |
| Reported Formula |
C19H15NO |
| SMILES |
C(C(C)C)(=O)C=1C=C(C=CC1)C#CC1=CC=C(C=C1)C#N |
| SPLASH |
splash10-004i-0090000000-4dc59b04ed36feabb5d2 |
| Source of Spectrum |
ACI-56-SM12-6f (DOI: 10.1002/anie.201704400) |
| Wiley ID |
1896192 |
