| SpectraBase Spectrum ID |
Kpl0XYN9z0q |
| Name |
4-Acetyl-3-allylbenzonitrile |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
185.084063977 u |
| Formula |
C12H11NO |
| InChI |
InChI=1S/C12H11NO/c1-3-4-11-7-10(8-13)5-6-12(11)9(2)14/h3,5-7H,1,4H2,2H3 |
| InChIKey |
QOTLBIBVSPEYBE-UHFFFAOYSA-N |
| Instrument Name |
Finnigan MAT 95 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201601560 |
| Molecular Weight |
185.226 g/mol |
| Quality |
161 |
| Reported Formula |
C12H11NO |
| SMILES |
C(C)(=O)C1=C(C=C(C=C1)C#N)CC=C |
| SPLASH |
splash10-00di-0900000000-3515cc026dd8fe1c3190 |
| Source of Spectrum |
ACI-55-SM10-3ja (DOI: 10.1002/anie.201601560) |
| Thin-Layer Chromatography |
0.4 (n-hexane/EtOAc, 5:1) |
| Wiley ID |
1904458 |
