| SpectraBase Spectrum ID |
GFFWV8NeAfi |
| Name |
(Z)-1-Cyanopent-1-en-2-yl 4-methylbenzenesulfonate |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H15NO3S |
| InChI |
InChI=1S/C13H15NO3S/c1-3-4-12(9-10-14)17-18(15,16)13-7-5-11(2)6-8-13/h5-9H,3-4H2,1-2H3/b12-9- |
| InChIKey |
OISNZDPMIBMNTR-XFXZXTDPSA-N |
| Instrument Name |
Finnigan MAT95Q/Finnigan MAT90 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202012085 |
| Molecular Weight |
265.327 g/mol |
| SMILES |
C(#N)\C=C\(CCC)OS(c1ccc(cc1)C)(=O)=O |
| SPLASH |
splash10-0fri-3900000000-2c7db41d5f503c173bb9 |
| Sample Comments |
Z/E = 99:1 |
| Source of Spectrum |
ACI-60-SM58-58-1 |
| Wiley ID |
1880401 |
