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Octanoic acid, 2-[(trifluoroacetyl)amino]-, butyl ester
SpectraBase Compound ID HG75ekmJTgF
InChI InChI=1S/C14H24F3NO3/c1-3-5-7-8-9-11(12(19)21-10-6-4-2)18-13(20)14(15,16)17/h11H,3-10H2,1-2H3,(H,18,20)
InChIKey KSZMRHQNONVVJZ-UHFFFAOYSA-N
Mol Weight 311.35 g/mol
Molecular Formula C14H24F3NO3
Exact Mass 311.170828 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DEbdtsK2hvf
Name Octanoic acid, 2-[(trifluoroacetyl)amino]-, butyl ester
Alternate Name(s) Butyl 2-[(trifluoroacetyl)amino]octanoate 2-[(2,2,2-trifluoro-1-oxoethyl)amino]octanoic acid butyl ester 2-[(2,2,2-trifluoroacetyl)amino]caprylic acid butyl ester Butyl 2-[(2,2,2-trifluoroacetyl)amino]octanoate Butyl 2-[2,2,2-tris(fluoranyl)ethanoylamino]octanoate
CAS Registry Number 56051-55-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H24F3NO3
InChI InChI=1S/C14H24F3NO3/c1-3-5-7-8-9-11(12(19)21-10-6-4-2)18-13(20)14(15,16)17/h11H,3-10H2,1-2H3,(H,18,20)
InChIKey KSZMRHQNONVVJZ-UHFFFAOYSA-N
Molecular Weight 311.345 g/mol
SMILES N(C(C(OCCCC)=O)CCCCCC)C(C(F)(F)F)=O
SPLASH splash10-052f-9000000000-ab401c9fe69561b0ad75
Source of Spectrum EP-1227-0-0
Wiley ID 1312285