SpectraBase Spectrum ID |
JcQmt7YiCwG |
Name |
(S)-3,3,3-Trifluoro-2-((4-methoxyphenyl)amino)-2-(3-nitrophenyl)propanenitrile |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C16H12F3N3O3 |
InChI |
InChI=1S/C16H12F3N3O3/c1-25-14-7-5-12(6-8-14)21-15(10-20,16(17,18)19)11-3-2-4-13(9-11)22(23)24/h2-9,21H,1H3/t15-/m1/s1 |
InChIKey |
DBQKJSLQJPPHIQ-OAHLLOKOSA-N |
Literature Reference DOI |
10.1002/adsc.201000666 |
Molecular Weight |
351.285 g/mol |
SMILES |
N([C@@](c1cc(ccc1)[N+](=O)[O-])(C#N)C(F)(F)F)c1ccc(cc1)OC |
SPLASH |
splash10-00di-0901000000-899106afa44b700b0cc2 |
Source of Spectrum |
ASC-352-3147/SM18-2g |
Wiley ID |
1764211 |