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2-Amino-6-hydroxyhexanoic acid, N,o-di(trifluoroacetyl)-, N-butyl ester

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2-Amino-6-hydroxyhexanoic acid, N,o-di(trifluoroacetyl)-, N-butyl ester
SpectraBase Compound ID FS6z9lAWjKn
InChI InChI=1S/C14H19F6NO5/c1-2-3-7-25-10(22)9(21-11(23)13(15,16)17)6-4-5-8-26-12(24)14(18,19)20/h9H,2-8H2,1H3,(H,21,23)
InChIKey HXSMZUOZKIIMHS-UHFFFAOYSA-N
Mol Weight 395.3 g/mol
Molecular Formula C14H19F6NO5
Exact Mass 395.116742 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Q8cBAGkayF
Name 2-Amino-6-hydroxyhexanoic acid, N,o-di(trifluoroacetyl)-, N-butyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 395.116741689 u
Formula C14H19F6NO5
InChI InChI=1S/C14H19F6NO5/c1-2-3-7-25-10(22)9(21-11(23)13(15,16)17)6-4-5-8-26-12(24)14(18,19)20/h9H,2-8H2,1H3,(H,21,23)
InChIKey HXSMZUOZKIIMHS-UHFFFAOYSA-N
Molecular Weight 395.298 g/mol
SMILES C(C(NC(C(OCCCC)=O)CCCCOC(C(F)(F)F)=O)=O)(F)(F)F