SpectraBase Spectrum ID |
3DHIgG9hsYo |
Name |
Methyl (R)-2-(4-fluorophenyl)propionate |
Appearance |
Colourless oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
182.074307755 u |
Formula |
C10H11FO2 |
InChI |
InChI=1S/C10H11FO2/c1-7(10(12)13-2)8-3-5-9(11)6-4-8/h3-7H,1-2H3/t7-/m1/s1 |
InChIKey |
HRSNKYJSOMIHNH-SSDOTTSWSA-N |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/chem.201603022 |
Molecular Weight |
182.194 g/mol |
Optical Rotation |
[a]D20 = -42.9 (c = 0.14, CHCl3) |
Quality |
56 |
Reported Formula |
C10H11FO2 |
SMILES |
COC([C@](C)(C1=CC=C(C=C1)F)[H])=O |
SPLASH |
splash10-00e9-0900000000-5320a4b3ca6853fd6797 |
Sample Comments |
45% ee |
Source of Spectrum |
QE-22-SM29-9h (DOI: 10.1002/chem.201603022) |
Wiley ID |
1905252 |