| SpectraBase Spectrum ID |
6uaTuUrsI1X |
| Name |
2-Cyclohexen-1-one, 4-[2-(dimethylamino)ethyl]-4-(4-hydroxyphenyl)-, (S)- |
| CAS Registry Number |
28379-30-8 |
| Comments |
Removed - expert review: contamination (acetone)) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H21NO2 |
| InChI |
InChI=1S/C16H21NO2/c1-17(2)12-11-16(9-7-15(19)8-10-16)13-3-5-14(18)6-4-13/h3-7,9,18H,8,10-12H2,1-2H3/t16-/m0/s1 |
| InChIKey |
QVPLXXHKAJMJHF-INIZCTEOSA-N |
| Molecular Weight |
259.349 g/mol |
| SMILES |
Oc1ccc([C@]2(C=CC(CC2)=O)CCN(C)C)cc1 |
| SPLASH |
splash10-0a4i-9000000000-a7faeb9dd9e647b4eed3 |
| Source of Spectrum |
F-46-7113-4 |
| Synonyms |
Joubertiamine
(4S)-4-[2-(dimethylamino)ethyl]-4-(4-hydroxyphenyl)-2-cyclohexen-1-one
(4S)-4-[2-(dimethylamino)ethyl]-4-(4-hydroxyphenyl)-1-cyclohex-2-enone |
| Wiley ID |
1262864 |
![2-Cyclohexen-1-one, 4-[2-(dimethylamino)ethyl]-4-(4-hydroxyphenyl)-, (S)-](/api/spectrum/6uaTuUrsI1X/structure.png?h=300&w=458 "2-Cyclohexen-1-one, 4-[2-(dimethylamino)ethyl]-4-(4-hydroxyphenyl)-, (S)-")
