| SpectraBase Spectrum ID |
IKVJ6H5yCKN |
| Name |
(S)-N-Butyl-2-((4-methoxyphenyl)(phenylthio)methyl)aniline |
| Appearance |
Colorless solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
377.181335666 u |
| Formula |
C24H27NOS |
| InChI |
InChI=1S/C24H27NOS/c1-3-4-18-25-23-13-9-8-12-22(23)24(27-21-10-6-5-7-11-21)19-14-16-20(26-2)17-15-19/h5-17,24-25H,3-4,18H2,1-2H3/t24-/m0/s1 |
| InChIKey |
ABTFXSCAEXYTPJ-DEOSSOPVSA-N |
| Instrument Name |
Shimadzu GC-MS QP2010 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201511179 |
| Molecular Weight |
377.546 g/mol |
| Optical Rotation |
[a]D(RT) = +80.2 (c = 2.0, CHCl3) |
| Quality |
15 |
| SMILES |
N(C1=C(C=CC=C1)[C@](C1=CC=C(C=C1)OC)(SC1=CC=CC=C1)[H])CCCC |
| SPLASH |
splash10-03di-0910000000-d8440c9e53f787992407 |
| Sample Comments |
91% ee |
| Source of Spectrum |
ACI-55-SM28-6m (DOI: 10.1002/anie.201511179) |
| Wiley ID |
1897310 |
