| SpectraBase Spectrum ID |
BlRMeZLgHht |
| Name |
(3S,SS)-N-(tert-Butanesulfinyl)-N-(2-propyl)-1-phenylhex-5-en-3-amine |
| Appearance |
Orange wax |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H27NOS |
| InChI |
InChI=1S/C19H27NOS/c1-6-11-18(15-14-17-12-9-8-10-13-17)20(16-7-2)22(21)19(3,4)5/h2,6,8-10,12-13,18H,1,11,14-16H2,3-5H3/t18-,22?/m1/s1 |
| InChIKey |
NVVMHVAMEFRIJO-ZZWBGTBQSA-N |
| Instrument Name |
LRMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.201901590 |
| Molecular Weight |
317.491 g/mol |
| Optical Rotation |
[a]20D = -70.0 (c = 1.18, CH2Cl2) |
| Reported Formula |
C19H27NOS |
| SMILES |
C([C@](N([S@](C(C)(C)C)=O)CC#C)(CC=C)[H])Cc1ccccc1 |
| SPLASH |
splash10-01bc-9670000000-8714d4e3f460502747c7 |
| Source of Spectrum |
U1-2020-121-ent-14a |
| Thin-Layer Chromatography |
Rf = 0.47 (hexane/EtOAc, 4:1) |
| Wiley ID |
1856955 |
