SpectraBase Spectrum ID |
Er9kFW1dOf4 |
Name |
(3R,4R)-3-Hydroxy-5-nitro-4-[2-(trifluoromethyl)phenyl]pentan-2-one |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C12H12F3NO4 |
InChI |
InChI=1S/C12H12F3NO4/c1-7(17)11(18)9(6-16(19)20)8-4-2-3-5-10(8)12(13,14)15/h2-5,9,11,18H,6H2,1H3/t9-,11-/m0/s1 |
InChIKey |
VTYQXHBILZEGAH-ONGXEEELSA-N |
Literature Reference DOI |
10.1002/adsc.200404037 |
Molecular Weight |
291.226 g/mol |
SMILES |
O[C@@](C(C)=O)([C@@](C[N+](=O)[O-])(c1ccccc1C(F)(F)F)[H])[H] |
SPLASH |
splash10-0ul0-1910000000-548d126c94c376834bc9 |
Source of Spectrum |
ASC-346-1162-anti_10e |
Synonyms |
(3R,4R)-3-hydroxy-5-nitro-4-(2-(trifluoromethyl)phenyl)pentan-2-one |
Wiley ID |
1767672 |