| SpectraBase Spectrum ID |
LXrDDyLSwsC |
| Name |
(R)-3-Methyl-5-Phenylpent-4-ynal |
| Appearance |
Pale yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H12O |
| InChI |
InChI=1S/C12H12O/c1-11(9-10-13)7-8-12-5-3-2-4-6-12/h2-6,10-11H,9H2,1H3/t11-/m0/s1 |
| InChIKey |
JFHBGRAUQPKSJN-NSHDSACASA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/adsc.201900177 |
| Molecular Weight |
172.227 g/mol |
| Optical Rotation |
[a]D = -24.0 (c = 0.8, CH2Cl2) |
| SMILES |
C(C[C@](C#Cc1ccccc1)(C)[H])=O |
| SPLASH |
splash10-004i-0900000000-004acd9e353ff416281c |
| Sample Comments |
87% ee |
| Source of Spectrum |
ASC-361-2646-(R)-8a |
| Wiley ID |
1836658 |
