SpectraBase Spectrum ID |
11U4a1PuXGC |
Name |
ethyl (E)-4-(5-methyl-1-oxo-1-phenylhex-2-en-2-yl)benzoate |
Appearance |
Yellow oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
336.172544630 u |
Formula |
C22H24O3 |
GC Column |
HP-5MS (0.25 mm x 30 m, film thickness 0.25 micrometer) |
GC Oven Program |
Oven temp 290oC or 320oC |
InChI |
InChI=1S/C22H24O3/c1-4-25-22(24)19-13-11-17(12-14-19)20(15-10-16(2)3)21(23)18-8-6-5-7-9-18/h5-9,11-16H,4,10H2,1-3H3/b20-15+ |
InChIKey |
UHAUXTFCXVGINJ-HMMYKYKNSA-N |
Instrument Name |
Agilent Technologies 7890A-Agilent 5975C VL MSD or Agilent 5975 inert |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/chem.201600710 |
Molecular Weight |
336.431 g/mol |
Quality |
148 |
Reported Formula |
C22H24O3 |
SMILES |
C(C)OC(C1=CC=C(C=C1)\C(C(C1=CC=CC=C1)=O)=C/CC(C)C)=O |
SPLASH |
splash10-0a4i-2933000000-1cd3754a0b72bb1f16b5 |
Source of Spectrum |
QE-22-SM20-3ag (DOI: 10.1002/chem.201600710) |
Thin-Layer Chromatography |
0.48 (pentane/EtOAc, 5:1) |
Wiley ID |
1903163 |