| SpectraBase Spectrum ID |
2vRXVCbbhYU |
| Name |
(S)-4-(3,5-dimethylphenyl)butan-2-ol |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
178.135765199 u |
| Formula |
C12H18O |
| InChI |
InChI=1S/C12H18O/c1-9-6-10(2)8-12(7-9)5-4-11(3)13/h6-8,11,13H,4-5H2,1-3H3/t11-/m0/s1 |
| InChIKey |
SELSZPVXLDHVSY-NSHDSACASA-N |
| Instrument Name |
Finnigan MAT95Q or Finnigan MAT90 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202203807 |
| Molecular Weight |
178.275 g/mol |
| Quality |
136 |
| Reported Formula |
C12H18O |
| SMILES |
O[C@](CCC1=CC(=CC(C)=C1)C)(C)[H] |
| SPLASH |
splash10-0601-0900000000-ddb1de2f92ab6140246a |
| Sample Comments |
>99% ee |
| Source of Spectrum |
ACI-61-SM33-10h (DOI: 10.1002/anie.202203807) |
| Wiley ID |
1897797 |
