| SpectraBase Spectrum ID |
4Iz7wePjywC |
| Name |
(3R,4S,5R)-3,4-dimethyl-5-(2-phenylethyl)tetrahydrofuran-2-one |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
218.130679818 u |
| Formula |
C14H18O2 |
| InChI |
InChI=1S/C14H18O2/c1-10-11(2)14(15)16-13(10)9-8-12-6-4-3-5-7-12/h3-7,10-11,13H,8-9H2,1-2H3/t10-,11+,13+/m0/s1 |
| InChIKey |
JALFREPJGKFMFE-DMDPSCGWSA-N |
| Instrument Name |
Finnigan MAT 95Q or Finnigan MAT 90 or JEOL JMS-700 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201601911 |
| Molecular Weight |
218.296 g/mol |
| Quality |
161 |
| Reported Formula |
C14H18O2 |
| SMILES |
C1(O[C@@]([C@]([C@]1(C)[H])(C)[H])(CCC1=CC=CC=C1)[H])=O |
| SPLASH |
splash10-0006-4920000000-82ba3300924b6072a816 |
| Sample Comments |
dr = 99:1:0:0 |
| Source of Spectrum |
QE-22-SM45-(rac)-(3R,4S,5R)-12 (DOI: 10.1002/chem.201601911) |
| Wiley ID |
1903491 |
