| SpectraBase Spectrum ID |
B7A7R1znhQT |
| Name |
(R)-1-cyclopropyl-2-ethyl-2-hydroxy-4-phenylbut-3-yn-1-one |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
228.115029753 u |
| Formula |
C15H16O2 |
| InChI |
InChI=1S/C15H16O2/c1-2-15(17,14(16)13-8-9-13)11-10-12-6-4-3-5-7-12/h3-7,13,17H,2,8-9H2,1H3/t15-/m1/s1 |
| InChIKey |
JLFSLAQWFOXKTR-OAHLLOKOSA-N |
| Instrument Name |
Agilent 7890A-5975 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201501044 |
| Molecular Weight |
228.291 g/mol |
| Optical Rotation |
[a]D(rt) = -140.0 (c = 0.5, CH2Cl2) |
| Quality |
306 |
| Reported Formula |
C15H16O2 |
| SMILES |
O[C@](C#CC1=CC=CC=C1)(C(C1CC1)=O)CC |
| SPLASH |
splash10-0a4i-3900000000-6887b3bd13d5c8d8cd09 |
| Sample Comments |
83% ee |
| Source of Spectrum |
QE-21-SM11-4r (DOI: 10.1002/chem.201501044) |
| Wiley ID |
1906616 |
