| SpectraBase Spectrum ID |
20hbbbtRgUO |
| Name |
ethyl (2R)-2-methyl-4-phenyl-butanoate |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
206.130679818 u |
| Formula |
C13H18O2 |
| InChI |
InChI=1S/C13H18O2/c1-3-15-13(14)11(2)9-10-12-7-5-4-6-8-12/h4-8,11H,3,9-10H2,1-2H3/t11-/m1/s1 |
| InChIKey |
REMSBSYLVOOMNU-LLVKDONJSA-N |
| Instrument Name |
Finnigan MAT 95Q or Finnigan MAT 90 or JEOL JMS-700 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201800792 |
| Molecular Weight |
206.285 g/mol |
| Optical Rotation |
[a]D23 = 2.4 (c = 0.11, CHCl3) |
| Quality |
141 |
| Reported Formula |
C13H18O2 |
| SMILES |
C=1C=C(CC[C@](C(OCC)=O)(C)[H])C=CC1 |
| SPLASH |
splash10-0udr-7910000000-460a8eab2c248563c3c6 |
| Sample Comments |
90.2% ee |
| Source of Spectrum |
ACI-57-SM35-R-9c (DOI: 10.1002/anie.201800792) |
| Wiley ID |
1890743 |
