| SpectraBase Spectrum ID |
2D7JzqRMCAk |
| Name |
Ethyl 4-(oct-1-yn-1-yl)benzoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H22O2 |
| InChI |
InChI=1S/C17H22O2/c1-3-5-6-7-8-9-10-15-11-13-16(14-12-15)17(18)19-4-2/h11-14H,3-8H2,1-2H3 |
| InChIKey |
JYBCMTXIIMUMPZ-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1039/C5SC02583D |
| Molecular Weight |
258.361 g/mol |
| SMILES |
C(c1ccc(cc1)C#CCCCCCC)(=O)OCC |
| SPLASH |
splash10-02dl-1920000000-8d85d266a79500f21946 |
| Source of Spectrum |
CSS-7-89/SM12-3jb |
| Wiley ID |
1801104 |
