| SpectraBase Spectrum ID |
GKZw7ty9rB6 |
| Name |
4-(5,5-Dimethyl-1,3-dioxan-2-yl)benzonitrile |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H15NO2 |
| InChI |
InChI=1S/C13H15NO2/c1-13(2)8-15-12(16-9-13)11-5-3-10(7-14)4-6-11/h3-6,12H,8-9H2,1-2H3 |
| InChIKey |
LRBPBGFKBSTWIU-UHFFFAOYSA-N |
| Instrument Name |
HP 5890 GC-5989B MSD |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.202300820 |
| Molecular Weight |
217.268 g/mol |
| Quality |
193 |
| SMILES |
CC1(COC(OC1)C1=CC=C(C=C1)C#N)C |
| SPLASH |
splash10-0api-9450000000-50b3f80f1e6896222ce3 |
| Source of Spectrum |
QE-29-SM16-2r (DOI: 10.1002/chem.202300820) |
| Thin-Layer Chromatography |
0.57 (PE/EtOAc, 9:1) |
| Wiley ID |
1910299 |
