| SpectraBase Spectrum ID |
5CXgf5Juioy |
| Name |
L-Alloisoleucine, 4-oxo-N-(trifluoroacetyl)-, methyl ester |
| CAS Registry Number |
115527-72-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H12F3NO4 |
| InChI |
InChI=1S/C9H12F3NO4/c1-4(5(2)14)6(7(15)17-3)13-8(16)9(10,11)12/h4,6H,1-3H3,(H,13,16)/t4-,6+/m1/s1 |
| InChIKey |
XVDCMWUFIPDOCH-XINAWCOVSA-N |
| Molecular Weight |
255.193 g/mol |
| SMILES |
N(C(C(F)(F)F)=O)[C@@]([C@@](C(=O)C)(C)[H])(C(=O)OC)[H] |
| SPLASH |
splash10-03di-0090000000-ad755fd1bdb77f8be035 |
| Source of Spectrum |
F-43-5347-11 |
| Synonyms |
Methyl (2S,3S)-3-methyl-4-oxo-2-[(trifluoroacetyl)amino]pentanoate
Methyl (2S,3S)-4-oxo-N-trifluoroacetylisoeucinate |
| Wiley ID |
1258544 |
