SpectraBase Spectrum ID |
KxLCGecplOd |
Name |
(S)-1-(1-(3-Chlorophenyl)ethyl)-3-phenylthiourea |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C15H15ClN2S |
InChI |
InChI=1S/C15H15ClN2S/c1-11(12-6-5-7-13(16)10-12)17-15(19)18-14-8-3-2-4-9-14/h2-11H,1H3,(H2,17,18,19)/t11-/m0/s1 |
InChIKey |
MJQCYLWMCNESKG-NSHDSACASA-N |
Instrument Name |
Finnigan MAT 95 |
Ionization Type |
EI |
Literature Reference DOI |
10.3762/bjoc.8.160 |
Molecular Weight |
290.812 g/mol |
Optical Rotation |
[a]20D = 101 (c = 0.98, CHCl3) |
Reported Formula |
C15H15ClN2S |
SMILES |
N(c1ccccc1)C(N[C@](c1cccc(c1)Cl)(C)[H])=S |
SPLASH |
splash10-0006-2590000000-b6ffa822a260fd4edbb2 |
Source of Spectrum |
BJO-8-SM7-(S)-9e |
Thin-Layer Chromatography |
Rf = 0.22 (c-Hex/EtOAc, 5:1) |
Wiley ID |
1864977 |