| SpectraBase Spectrum ID |
AiwhRWUQY4L |
| Name |
1,2-dimethoxy-4-(pent-1-en-3-yl)benzene |
| Carrier Gas |
Hydrogen (1.7 ml/min, 1.2 bar) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
206.130679818 u |
| Formula |
C13H18O2 |
| GC Column |
Macherey-Nagel Optima-1-MS (30 m x 0.25 mm) |
| GC Oven Program |
Oven temp 300oC |
| InChI |
InChI=1S/C13H18O2/c1-5-10(6-2)11-7-8-12(14-3)13(9-11)15-4/h5,7-10H,1,6H2,2-4H3 |
| InChIKey |
RCVANSMTGJQWAO-UHFFFAOYSA-N |
| Instrument Name |
Agilent 5973 N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201601283 |
| Molecular Weight |
206.285 g/mol |
| Optical Rotation |
[a]D20 = -13.1 (c = 0.7 g/100 ml, CHCl3) |
| Quality |
237 |
| SMILES |
COC1=C(C=CC(=C1)C(C=C)CC)OC |
| SPLASH |
splash10-004i-1920000000-3be202bece22a36ff5ea |
| Sample Comments |
84% ee |
| Source of Spectrum |
QE-22-SM47-47-1 (DOI: 10.1002/chem.201601283) |
| Thin-Layer Chromatography |
0.6 (CyHex/EtOAc, 5:1) |
| Wiley ID |
1903371 |
