| SpectraBase Spectrum ID |
4a0JtgYPonV |
| Name |
2-(6-Methoxy-2,5,7,8-tetramethylchroman-2-yl)-1-phenylethan-1-one |
| Carrier Gas |
Hydrogen (30 ml/min, 1.2 bar) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
338.188194694 u |
| Formula |
C22H26O3 |
| GC Column |
Optima-1-MS (30 m x 0.25 mm) |
| GC Oven Program |
Oven temp 300oC |
| InChI |
InChI=1S/C22H26O3/c1-14-15(2)21-18(16(3)20(14)24-5)11-12-22(4,25-21)13-19(23)17-9-7-6-8-10-17/h6-10H,11-13H2,1-5H3 |
| InChIKey |
BBQBWJAIERDFCS-UHFFFAOYSA-N |
| Instrument Name |
Agilent HP6890-5937 N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.202004843 |
| Molecular Weight |
338.447 g/mol |
| Optical Rotation |
[a]D20 = 8.30 (589nm) (c = 0.265/100ml, CH3Cl) |
| Quality |
336 |
| SMILES |
COC1=C(C2=C(C(=C1C)C)OC(CC2)(CC(C1=CC=CC=C1)=O)C)C |
| SPLASH |
splash10-0a70-3935000000-b567da5061e37c664955 |
| Sample Comments |
92% ee |
| Source of Spectrum |
QE-27-SM44-12b (DOI: 10.1002/chem.202004843) |
| Thin-Layer Chromatography |
0.44 (SiO2, cHex/EtOAc, 5:1) |
| Wiley ID |
1901992 |
