| SpectraBase Spectrum ID |
CkrRD9jjDaY |
| Name |
TAB - Isoleucine |
| CAS Registry Number |
2505-28-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H20F3NO3 |
| InChI |
InChI=1S/C12H20F3NO3/c1-4-6-7-19-10(17)9(8(3)5-2)16-11(18)12(13,14)15/h8-9H,4-7H2,1-3H3,(H,16,18)/t8-,9-/m0/s1 |
| InChIKey |
RXCCQFOMEQOSMR-IUCAKERBSA-N |
| Molecular Weight |
283.291 g/mol |
| SMILES |
N(C(C(F)(F)F)=O)[C@](C(=O)OCCCC)([C@](CC)(C)[H])[H] |
| SPLASH |
splash10-0kur-7900000000-3954b0544ab2dc5ba8cf |
| Source of Spectrum |
W-0-1-444 |
| Synonyms |
Butyl (2S,3S)-3-methyl-2-[(trifluoroacetyl)amino]pentanoate
N-(Trifluoroacetyl)isoleucine-butyl ester
(2S,3S)-3-methyl-2-[(2,2,2-trifluoro-1-oxoethyl)amino]pentanoic acid butyl ester
Butyl (2S,3S)-3-methyl-2-[(2,2,2-trifluoroacetyl)amino]pentanoate
Butyl (2S,3S)-3-methyl-2-[2,2,2-tris(fluoranyl)ethanoylamino]pentanoate |
| Wiley ID |
754122 |
