| SpectraBase Spectrum ID |
DGY5zwXXSBa |
| Name |
(1S)-N-(tert-Butanesulfonyl)-N-(2-propyl)-1-phenylbut-3-yn-1-amine |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H21NO2S |
| InChI |
InChI=1S/C17H21NO2S/c1-6-11-16(15-12-9-8-10-13-15)18(14-7-2)21(19,20)17(3,4)5/h1-2,8-10,12-13,16H,11,14H2,3-5H3/t16-/m0/s1 |
| InChIKey |
BUSLKTGGCOVRSG-INIZCTEOSA-N |
| Instrument Name |
LRMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.201901590 |
| Molecular Weight |
303.420 g/mol |
| Optical Rotation |
[a]20D = +14.2 (c = 0.96, CH2Cl2) |
| Reported Formula |
C17H21NO2S |
| SMILES |
c1([C@@](N(S(C(C)(C)C)(=O)=O)CC#C)(CC#C)[H])ccccc1 |
| SPLASH |
splash10-0006-4910000000-aec3e82bb7b33dc890d2 |
| Source of Spectrum |
U1-2020-121-5b |
| Thin-Layer Chromatography |
Rf = 0.54 (hexane/EtOAc, 5:1) |
| Wiley ID |
1856934 |
