| SpectraBase Spectrum ID |
GmcbfTSoLbX |
| Name |
(E)-2-Benzylidene-3-hydroxy-3-phenylbutanenitrile |
| Appearance |
Slightly yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H15NO |
| InChI |
InChI=1S/C17H15NO/c1-17(19,15-10-6-3-7-11-15)16(13-18)12-14-8-4-2-5-9-14/h2-12,19H,1H3/b16-12+ |
| InChIKey |
FMYMYOYKTGGXMS-FOWTUZBSSA-N |
| Instrument Name |
Finnigan MAT95Q/Finnigan MAT90 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202012085 |
| Molecular Weight |
249.313 g/mol |
| Reported Formula |
C17H15NO |
| SMILES |
OC(\C(=C\c1ccccc1)C#N)(c1ccccc1)C |
| SPLASH |
splash10-0a4i-0790000000-b6a5f0c5335a0b0958c3 |
| Sample Comments |
E/Z = 99:1 |
| Source of Spectrum |
ACI-60-SM41-4as |
| Wiley ID |
1880400 |
