| SpectraBase Spectrum ID |
3GEpYaUH7w |
| Name |
4,4-bis(4-acetoxyphenyl) pentanoic acid |
| Appearance |
Colorless solid |
| Carrier Gas |
Methane |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
370.141638422 u |
| Formula |
C21H22O6 |
| InChI |
InChI=1S/C21H22O6/c1-14(22)26-18-8-4-16(5-9-18)21(3,13-12-20(24)25)17-6-10-19(11-7-17)27-15(2)23/h4-11H,12-13H2,1-3H3,(H,24,25) |
| InChIKey |
IIBALRXTGVJSPW-UHFFFAOYSA-N |
| Ionization Type |
EI Positive ion |
| Literature Reference DOI |
10.1002/chem.202201761 |
| Molecular Weight |
370.401 g/mol |
| Quality |
212 |
| Reported Formula |
C21H22O6 |
| SMILES |
OC(CCC(C1=CC=C(C=C1)OC(C)=O)(C1=CC=C(C=C1)OC(C)=O)C)=O |
| SPLASH |
splash10-08fv-1091000000-3e38e9cd9fdf0055b75d |
| Source of Spectrum |
QE-28-SM32-4p (DOI: 10.1002/chem.202201761) |
| Thin-Layer Chromatography |
0.35 (n-pentane/EtOAc, 1:1) |
| Wiley ID |
1900694 |
