| SpectraBase Spectrum ID |
5dAsUpwPsJT |
| Name |
(trans-1,2)-2-(4-methoxyphenyl)cyclohexyl benzoate |
| Appearance |
Colorless solid |
| Carrier Gas |
Methane |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
310.156894565 u |
| Formula |
C20H22O3 |
| InChI |
InChI=1S/C20H22O3/c1-22-17-13-11-15(12-14-17)18-9-5-6-10-19(18)23-20(21)16-7-3-2-4-8-16/h2-4,7-8,11-14,18-19H,5-6,9-10H2,1H3/t18-,19+/m1/s1 |
| InChIKey |
SWCAHUYCSMXKNK-MOPGFXCFSA-N |
| Ionization Type |
EI Positive ion |
| Literature Reference DOI |
10.1002/chem.202201761 |
| Molecular Weight |
310.393 g/mol |
| Quality |
121 |
| Reported Formula |
C20H22O3 |
| SMILES |
COC1=CC=C(C=C1)[C@@]1([C@](CCCC1)(OC(C1=CC=CC=C1)=O)[H])[H] |
| SPLASH |
splash10-0079-0900000000-7dbbf049fadbeb2527ec |
| Source of Spectrum |
QE-28-SM35-7c (DOI: 10.1002/chem.202201761) |
| Thin-Layer Chromatography |
0.15 (n-pentane/EtOAc, 20:1) |
| Wiley ID |
1900712 |
