| SpectraBase Spectrum ID |
5aXFyM41wnH |
| Name |
(3R)-2-(tert-Butanesulfonyl)-6,7-diethyl-3-(sec-butyl)-1,2,3,4-tetrahydroisoquinoline |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H35NO2S |
| InChI |
InChI=1S/C21H35NO2S/c1-8-16-11-18-13-20(10-15(3)4)22(25(23,24)21(5,6)7)14-19(18)12-17(16)9-2/h11-12,15,20H,8-10,13-14H2,1-7H3/t20-/m1/s1 |
| InChIKey |
HAJRZHQWSCDTMZ-HXUWFJFHSA-N |
| Instrument Name |
LRMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.201901590 |
| Molecular Weight |
365.576 g/mol |
| Optical Rotation |
[a]20D = +4.9 (c = 0.60, CH2Cl2) |
| Reported Formula |
C21H35NO2S |
| SMILES |
C([C@]1(N(S(C(C)(C)C)(=O)=O)Cc2c(C1)cc(c(c2)CC)CC)[H])C(C)C |
| SPLASH |
splash10-000i-1920000000-543d439f5e1df8e53aff |
| Source of Spectrum |
U1-2020-123-7g |
| Thin-Layer Chromatography |
Rf = 0.63 (hexane/EtOAc, 6:1) |
| Wiley ID |
1856944 |
