| SpectraBase Spectrum ID |
5ZVtqi8NVSp |
| Name |
3-(3,5-Dimethoxyphenyl)propanenitrile |
| Appearance |
Liquid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
191.094628661 u |
| Formula |
C11H13NO2 |
| InChI |
InChI=1S/C11H13NO2/c1-13-10-6-9(4-3-5-12)7-11(8-10)14-2/h6-8H,3-4H2,1-2H3 |
| InChIKey |
BVDMDQUQOAXBTE-UHFFFAOYSA-N |
| Instrument Name |
Thermo Finnigan TSQ 700 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.202005400 |
| Molecular Weight |
191.230 g/mol |
| Quality |
105 |
| Reported Formula |
C11H13NO2 |
| SMILES |
C1=C(C=C(C=C1CCC#N)OC)OC |
| SPLASH |
splash10-0udl-0900000000-2ed29639dc3028e2bf06 |
| Source of Spectrum |
QE-27-SM14-2h (DOI: 10.1002/chem.202005400) |
| Thin-Layer Chromatography |
0.3 (hexanes/EtOAc, 10:1) |
| Wiley ID |
1902079 |
