| SpectraBase Spectrum ID |
CAXGqBO595c |
| Name |
ethyl (4S)-4-hydroxy-3-methyl-5-methylene-non-2-enoate |
| Appearance |
Colorless liquid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
226.156894565 u |
| Formula |
C13H22O3 |
| InChI |
InChI=1S/C13H22O3/c1-5-7-8-10(3)13(15)11(4)9-12(14)16-6-2/h9,13,15H,3,5-8H2,1-2,4H3/t13-/m0/s1 |
| InChIKey |
UUIGSTQGKRMRMT-ZDUSSCGKSA-N |
| Instrument Name |
Finnigan MAT 8200 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201405790 |
| Molecular Weight |
226.316 g/mol |
| Optical Rotation |
[a]D20 = +28.0 (c = 1.00, CHCl3) |
| Quality |
491 |
| Reported Formula |
C13H22O3 |
| SMILES |
O[C@](C(=CC(OCC)=O)C)(C(=C)CCCC)[H] |
| SPLASH |
splash10-014l-9400000000-7dc61d27da0eb33a5cc7 |
| Sample Comments |
85% ee |
| Source of Spectrum |
QE-21-SM32-S10 (DOI: 10.1002/chem.201405790) |
| Wiley ID |
1907573 |
