| SpectraBase Spectrum ID |
4MlxM4jfAuZ |
| Name |
L-Valine, 4-chloro-4-oxo-N-(trifluoroacetyl)-, methyl ester, threo- |
| CAS Registry Number |
115527-71-4 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C8H9ClF3NO4 |
| InChI |
InChI=1S/C8H9ClF3NO4/c1-3(5(9)14)4(6(15)17-2)13-7(16)8(10,11)12/h3-4H,1-2H3,(H,13,16)/t3?,4-/m0/s1 |
| InChIKey |
FKKNDCVMCQHSHY-BKLSDQPFSA-N |
| Molecular Weight |
275.611 g/mol |
| SMILES |
N(C(C(F)(F)F)=O)[C@@](C(C(=O)Cl)C)(C(=O)OC)[H] |
| SPLASH |
splash10-03di-0090000000-05e52915e341f4bde4c2 |
| Source of Spectrum |
F-43-5347-9 |
| Synonyms |
.alpha.-methyl N-trifluoroacetyl-(2S,3S)-3-methylaspartyl-.beta.-acid-chloride
methyl (2S)-4-chloro-3-methyl-4-oxo-2-[(trifluoroacetyl)amino]butanoate |
| Wiley ID |
1278807 |
