SpectraBase Spectrum ID |
5T37G75jRiN |
Name |
Methyl (S)-2-Ethylpent-4-enoate |
Appearance |
Colorless liquid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
142.099379689 u |
Formula |
C8H14O2 |
InChI |
InChI=1S/C8H14O2/c1-4-6-7(5-2)8(9)10-3/h4,7H,1,5-6H2,2-3H3/t7-/m0/s1 |
InChIKey |
BCIXGZZMWYVOFR-ZETCQYMHSA-N |
Instrument Name |
ThermoFinnigan Trace GC |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/ejoc.201900822 |
Molecular Weight |
142.198 g/mol |
Optical Rotation |
[a]D24 = +0.5 (CHCl3, c = 1) |
Quality |
327 |
SMILES |
C(=C)C[C@](CC)(C(OC)=O)[H] |
SPLASH |
splash10-08gi-9700000000-f60b23239fa4f52dc1f9 |
Sample Comments |
30% ee |
Source of Spectrum |
K1-2019-SM3-(S)-5d (DOI: 10.1002/ejoc.201900822) |
Thin-Layer Chromatography |
0.8 (n-pentane/diethyl ether, 9:1) |
Wiley ID |
1891962 |