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1-Methyl-2-(4-acetoxyphenyl)-N-(trifluoroacetyl)-N-acetyl-ethylamine
SpectraBase Compound ID CsGl70KdUdV
InChI InChI=1S/C15H16F3NO4/c1-9(19(10(2)20)14(22)15(16,17)18)8-12-4-6-13(7-5-12)23-11(3)21/h4-7,9H,8H2,1-3H3
InChIKey CKVQCKQURQIQNM-UHFFFAOYSA-N
Mol Weight 331.29 g/mol
Molecular Formula C15H16F3NO4
Exact Mass 331.103142 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3jktiRybH6t
Name 1-Methyl-2-(4-acetoxyphenyl)-N-(trifluoroacetyl)-N-acetyl-ethylamine
Comments Computed using HOSE algorithm
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Exact Mass 331.103142484 u
Formula C15H16F3NO4
InChI InChI=1S/C15H16F3NO4/c1-9(19(10(2)20)14(22)15(16,17)18)8-12-4-6-13(7-5-12)23-11(3)21/h4-7,9H,8H2,1-3H3
InChIKey CKVQCKQURQIQNM-UHFFFAOYSA-N
Molecular Weight 331.291 g/mol
SMILES C(N(C(CC1=CC=C(OC(=O)C)C=C1)C)C(=O)C)(C(F)(F)F)=O