| SpectraBase Spectrum ID |
8kvsrZRmZG5 |
| Name |
(S,E)-6-(3-Methoxy-4-methylphenyl)-2-methylhept-2-en-1-yl acetate |
| Appearance |
Yellow oil |
| Carrier Gas |
Hydrogen |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
290.188194694 u |
| Formula |
C18H26O3 |
| GC Oven Program |
Oven temp 300 oC |
| InChI |
InChI=1S/C18H26O3/c1-13(12-21-16(4)19)7-6-8-14(2)17-10-9-15(3)18(11-17)20-5/h7,9-11,14H,6,8,12H2,1-5H3/b13-7+/t14-/m0/s1 |
| InChIKey |
VPGBUXOGGKPYPB-GUNGLEHYSA-N |
| Instrument Name |
Agilent GC6890-HP 5973 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.202200058 |
| Molecular Weight |
290.403 g/mol |
| Optical Rotation |
[a]D20 = 73.2 (436 nm), 40.0 (546 nm), 34.7 (579 nm), 32.7 (589 nm) (1.0 g/100 ml in CHCl3) |
| Quality |
204 |
| SMILES |
C1=C(C=C(C(=C1)C)OC)[C@](CC\C=C\(COC(C)=O)C)(C)[H] |
| SPLASH |
splash10-0012-1930000000-f788a6170f8d8bc679b4 |
| Source of Spectrum |
K1-2022-SM26-18 (DOI: 10.1002/ejoc.202200058) |
| Thin-Layer Chromatography |
0.4 (SiO2, cHex/EtOAc, 5:1) |
| Wiley ID |
1898685 |
