| SpectraBase Spectrum ID |
3fYXTcgqN4M |
| Name |
Ethyl 4-(4-nitrophenyl)-4-oxo-2-(trifluoromethyl)butanoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H12F3NO5 |
| InChI |
InChI=1S/C13H12F3NO5/c1-2-22-12(19)10(13(14,15)16)7-11(18)8-3-5-9(6-4-8)17(20)21/h3-6,10H,2,7H2,1H3 |
| InChIKey |
DJXHQQADOLGABB-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1002/asia.201201130 |
| Molecular Weight |
319.236 g/mol |
| SMILES |
c1cc(C(CC(C(=O)OCC)C(F)(F)F)=O)ccc1[N+](=O)[O-] |
| SPLASH |
splash10-0udi-7900000000-431c923d57ccbd684020 |
| Source of Spectrum |
CAJ-8-556/SM4-1d |
| Wiley ID |
1771937 |
