| SpectraBase Spectrum ID |
FTOw7P7erH9 |
| Name |
Ethyl (S)-4-Methylhexanoate |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H18O2 |
| GC Oven Program |
Split/Splitless injector |
| InChI |
InChI=1S/C9H18O2/c1-4-8(3)6-7-9(10)11-5-2/h8H,4-7H2,1-3H3/t8-/m0/s1 |
| InChIKey |
XLBBXJVJKKWJTQ-QMMMGPOBSA-N |
| Instrument Name |
Hewlett-Packard 6890-5973 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np030321z |
| Molecular Weight |
158.241 g/mol |
| Optical Rotation |
[a]D25 = +5.5 (c = 3.25, diethyl ether) |
| SMILES |
C(CC[C@](CC)(C)[H])(=O)OCC |
| SPLASH |
splash10-0zml-9300000000-921a053750efeb91f399 |
| Source of Spectrum |
G4-67-400-S-8 |
| Wiley ID |
1881682 |
