| SpectraBase Spectrum ID |
2iXJRDP6vo |
| Name |
(R)-4-hydroxy-4-methyl-6-phenylhex-5-yn-3-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
202.099379689 u |
| Formula |
C13H14O2 |
| InChI |
InChI=1S/C13H14O2/c1-3-12(14)13(2,15)10-9-11-7-5-4-6-8-11/h4-8,15H,3H2,1-2H3/t13-/m1/s1 |
| InChIKey |
PZPZHQFECKHOJP-CYBMUJFWSA-N |
| Instrument Name |
Agilent 7890A-5975 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201501044 |
| Molecular Weight |
202.253 g/mol |
| Optical Rotation |
[a]D(rt) = -164.4 (c = 0.7, CH2Cl2) |
| Quality |
363 |
| Reported Formula |
C13H14O2 |
| SMILES |
O[C@](C#CC1=CC=CC=C1)(C(CC)=O)C |
| SPLASH |
splash10-002e-6900000000-07625e83123c32955d59 |
| Sample Comments |
82% ee |
| Source of Spectrum |
QE-21-SM12-4s (DOI: 10.1002/chem.201501044) |
| Wiley ID |
1906617 |
