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Benzenemethanol, .alpha.-(1-aminobutyl)-, N,o-bis(trifluoroacetyl)-

View entire compound with spectra: 1 NMR

Benzenemethanol, .alpha.-(1-aminobutyl)-, N,o-bis(trifluoroacetyl)-
SpectraBase Compound ID 9OOFacQlqfj
InChI InChI=1S/C15H15F6NO3/c1-2-6-10(22-12(23)14(16,17)18)11(9-7-4-3-5-8-9)25-13(24)15(19,20)21/h3-5,7-8,10-11H,2,6H2,1H3,(H,22,23)
InChIKey YXYUXGCDKMRNRR-UHFFFAOYSA-N
Mol Weight 371.28 g/mol
Molecular Formula C15H15F6NO3
Exact Mass 371.095612 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9huXG1OKbjG
Name Benzenemethanol, .alpha.-(1-aminobutyl)-, N,o-bis(trifluoroacetyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 371.095612322 u
Formula C15H15F6NO3
InChI InChI=1S/C15H15F6NO3/c1-2-6-10(22-12(23)14(16,17)18)11(9-7-4-3-5-8-9)25-13(24)15(19,20)21/h3-5,7-8,10-11H,2,6H2,1H3,(H,22,23)
InChIKey YXYUXGCDKMRNRR-UHFFFAOYSA-N
Molecular Weight 371.279 g/mol
SMILES C(C(CCC)NC(C(F)(F)F)=O)(OC(C(F)(F)F)=O)C1=CC=CC=C1