| SpectraBase Spectrum ID |
HdLHu6s5wj8 |
| Name |
1-(6-Methoxy-2,5,7,8-tetramethylchroman-2-yl)-4-(methoxy-methoxy)butan-2-one |
| Carrier Gas |
Hydrogen (30 ml/min, 1.2 bar) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
350.209324061 u |
| Formula |
C20H30O5 |
| GC Column |
Optima-1-MS (30 m x 0.25 mm) |
| GC Oven Program |
Oven temp 300oC |
| InChI |
InChI=1S/C20H30O5/c1-13-14(2)19-17(15(3)18(13)23-6)7-9-20(4,25-19)11-16(21)8-10-24-12-22-5/h7-12H2,1-6H3 |
| InChIKey |
PVUQPRAZAQAVPT-UHFFFAOYSA-N |
| Instrument Name |
Agilent HP6890-5937 N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.202004843 |
| Molecular Weight |
350.455 g/mol |
| Optical Rotation |
[a]D20 = 3.87 (589nm) (c = 0.155/100ml, CH3Cl) |
| Quality |
246 |
| SMILES |
COC1=C(C2=C(C(=C1C)C)OC(CC2)(CC(CCOCOC)=O)C)C |
| SPLASH |
splash10-0udi-3598000000-dde462b08a1372c5c2fb |
| Sample Comments |
83% ee |
| Source of Spectrum |
QE-27-SM48-12g (DOI: 10.1002/chem.202004843) |
| Thin-Layer Chromatography |
0.41 (SiO2, cHex/EtOAc, 5:2) |
| Wiley ID |
1901996 |
