| SpectraBase Spectrum ID |
2FmnqGQDCHD |
| Name |
(3R,4R)-3-Mercapto-1,4-diphenyl-6-((E)-styryl)-3,4-dihydropyridin-2(1H)-one |
| Appearance |
Buff powder |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H21NOS |
| InChI |
InChI=1S/C25H21NOS/c27-25-24(28)23(20-12-6-2-7-13-20)18-22(17-16-19-10-4-1-5-11-19)26(25)21-14-8-3-9-15-21/h1-18,23-24,28H/b17-16+/t23-,24-/m1/s1 |
| InChIKey |
MUDHHGHQPQMIGP-KAAYJFPCSA-N |
| Instrument Name |
Kratos MS equipment or Varian MAT 311A |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.2756 |
| Molecular Weight |
383.509 g/mol |
| SMILES |
S[C@]1(C(N(C(=C[C@@]1(c1ccccc1)[H])\C=C\c1ccccc1)c1ccccc1)=O)[H] |
| SPLASH |
splash10-0ugi-5950000000-8c7af0acae1a117b8ea5 |
| Source of Spectrum |
Y-54-1773-5 |
| Thin-Layer Chromatography |
Rf = 0.54 (pet.ether (40:60)/ethyl acetate, 8:5) |
| Wiley ID |
1878332 |
