| SpectraBase Spectrum ID |
3MbSiWuPDMM |
| Name |
(2S,5S)-5-benzyl-3-methyl-2-(4-cyanophenyl)imidazolidin-4-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H17N3O |
| InChI |
InChI=1S/C18H17N3O/c1-21-17(15-9-7-14(12-19)8-10-15)20-16(18(21)22)11-13-5-3-2-4-6-13/h2-10,16-17,20H,11H2,1H3/t16-,17-/m0/s1 |
| InChIKey |
AWWZWFLASTWHBB-IRXDYDNUSA-N |
| Instrument Name |
Finnigan MAT 95 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3762/bjoc.8.160 |
| Molecular Weight |
291.354 g/mol |
| Optical Rotation |
[a]20D = -144 (c = 1.04, CHCl3) |
| Reported Formula |
C18H17N3O |
| SMILES |
N1[C@@](N(C([C@@]1(Cc1ccccc1)[H])=O)C)(c1ccc(cc1)C#N)[H] |
| SPLASH |
splash10-0udi-0190000000-ae79412e112b707306e8 |
| Source of Spectrum |
BJO-8-SM20-(2S,5S)-15f |
| Thin-Layer Chromatography |
Rf = 0.05 (c-Hex/EtOAc, 1:1) |
| Wiley ID |
1864967 |
