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Ethcathinone TFA
SpectraBase Compound ID Jhslb0e0LlV
InChI InChI=1S/C13H14F3NO2/c1-3-17(12(19)13(14,15)16)9(2)11(18)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3
InChIKey VYXUQWQGVMNGHL-UHFFFAOYSA-N
Mol Weight 273.26 g/mol
Molecular Formula C13H14F3NO2
Exact Mass 273.097663 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AYVUElu0vKa
Name N-Ethylcathinone, N-trifluoroacetyl-
Comments Computed using HOSE algorithm
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Exact Mass 273.097663182 u
Formula C13H14F3NO2
InChI InChI=1S/C13H14F3NO2/c1-3-17(12(19)13(14,15)16)9(2)11(18)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3
InChIKey VYXUQWQGVMNGHL-UHFFFAOYSA-N
Molecular Weight 273.255 g/mol
SMILES C1(=CC=CC=C1)C(C(C)N(CC)C(C(F)(F)F)=O)=O