| SpectraBase Spectrum ID |
DKldpk94R2Y |
| Name |
Ethyl trans-1-benzoyl-2-(4-methoxyphenyl)cyclopropane-1-carboxylate |
| Appearance |
Light yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H20O4 |
| InChI |
InChI=1S/C20H20O4/c1-3-24-19(22)20(18(21)15-7-5-4-6-8-15)13-17(20)14-9-11-16(23-2)12-10-14/h4-12,17H,3,13H2,1-2H3/t17-,20+/m1/s1 |
| InChIKey |
LQBQZCSGKUINTA-XLIONFOSSA-N |
| Instrument Name |
Finnigan MAT 8200 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/jacs.2c02258 |
| Molecular Weight |
324.376 g/mol |
| Optical Rotation |
[a]D20 = 217.4 (c = 1.0, CHCl3) |
| Quality |
136 |
| SMILES |
[C@]1([C@](C1)(C=1C=CC(=CC1)OC)[H])(C(=O)C1=CC=CC=C1)C(OCC)=O |
| SPLASH |
splash10-0a6r-2961000000-2925bf39cac1a4fcd63d |
| Source of Spectrum |
C-144-SM50-trans-8a (DOI: 10.1021/jacs.2c02258) |
| Wiley ID |
1910675 |
