SpectraBase Spectrum ID |
1ZiyP16pLcZ |
Name |
(S)-N-Isopropyl-2-((4-methoxyphenyl)(phenylthio)methyl)aniline |
Appearance |
Colorless solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C23H25NOS |
InChI |
InChI=1S/C23H25NOS/c1-17(2)24-22-12-8-7-11-21(22)23(26-20-9-5-4-6-10-20)18-13-15-19(25-3)16-14-18/h4-17,23-24H,1-3H3/t23-/m0/s1 |
InChIKey |
JQHJJABSGPTIEY-QHCPKHFHSA-N |
Instrument Name |
Shimadzu GC-MS QP2010 |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/anie.201511179 |
Molecular Weight |
363.519 g/mol |
Optical Rotation |
[a]D(RT) = +86.7 (c = 1.6, CHCl3) |
Quality |
45 |
SMILES |
N(C1=C(C=CC=C1)[C@](C1=CC=C(C=C1)OC)(SC1=CC=CC=C1)[H])C(C)C |
SPLASH |
splash10-0a4i-0920000000-87a709b2f6d716be408a |
Sample Comments |
89% ee |
Source of Spectrum |
ACI-55-SM28-6l (DOI: 10.1002/anie.201511179) |
Wiley ID |
1897309 |