| SpectraBase Spectrum ID |
CjR8X2vVhzm |
| Name |
(4S,5R)-5-Ethyl-4-fluoro-5-phenylpyrrolidin-2-one |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
207.105942237 u |
| Formula |
C12H14FNO |
| InChI |
InChI=1S/C12H14FNO/c1-2-12(9-6-4-3-5-7-9)10(13)8-11(15)14-12/h3-7,10H,2,8H2,1H3,(H,14,15)/t10-,12+/m0/s1 |
| InChIKey |
ISQYUOXGKVBLGN-CMPLNLGQSA-N |
| Instrument Name |
Thermo Finnigan Polaris Q |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.201900685 |
| Molecular Weight |
207.248 g/mol |
| Optical Rotation |
[a]D26 = -123.7 (c = 1.0, CHCl3) |
| Quality |
181 |
| Reported Formula |
C12H14FNO |
| SMILES |
N1[C@]([C@](CC1=O)(F)[H])(CC)C1=CC=CC=C1 |
| SPLASH |
splash10-004i-0900000000-eeb88b2e4ce421099df4 |
| Source of Spectrum |
K1-2019-4718-(4S,5R)-2l (DOI: 10.1002/ejoc.201900685) |
| Wiley ID |
1891972 |
