| SpectraBase Spectrum ID |
JCQgNN5AVVm |
| Name |
(4R,RS)-N-(tert-Butanesulfinyl)-N-(2-propyl)tridec-1-yn-4-amine |
| Appearance |
Brown oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H35NOS |
| InChI |
InChI=1S/C20H35NOS/c1-7-10-11-12-13-14-15-17-19(16-8-2)21(18-9-3)23(22)20(4,5)6/h2-3,19H,7,10-18H2,1,4-6H3/t19-,23?/m0/s1 |
| InChIKey |
CAVMCJITFQDCJD-HSTJUUNISA-N |
| Instrument Name |
LRMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.201901590 |
| Molecular Weight |
337.566 g/mol |
| Optical Rotation |
[a]20D = +90.8 (c = 1.05, CH2Cl2) |
| Reported Formula |
C20H35NOS |
| SMILES |
C([C@@](N([S@](=O)C(C)(C)C)CC#C)(CC#C)[H])CCCCCCCC |
| SPLASH |
splash10-0006-1190000000-9f78ef05309a31b2edef |
| Source of Spectrum |
U1-2020-120-4d |
| Thin-Layer Chromatography |
Rf = 0.53 (hexane/EtOAc, 4:1) |
| Wiley ID |
1856931 |
