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N-(2-Furylmethyl)-1-phenylethanamine, 1ac derivative
SpectraBase Compound ID m22Jt4h7Xv
InChI InChI=1S/C15H17NO2/c1-12(14-7-4-3-5-8-14)16(13(2)17)11-15-9-6-10-18-15/h3-10,12H,11H2,1-2H3
InChIKey CQIZWZSAHHTJHH-UHFFFAOYSA-N
Mol Weight 243.31 g/mol
Molecular Formula C15H17NO2
Exact Mass 243.125929 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CaeEuL3aWFq
Name N-(2-Furylmethyl)-1-phenylethanamine, 1ac derivative
Comments Computed using HOSE algorithm
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Exact Mass 243.125928789 u
Formula C15H17NO2
InChI InChI=1S/C15H17NO2/c1-12(14-7-4-3-5-8-14)16(13(2)17)11-15-9-6-10-18-15/h3-10,12H,11H2,1-2H3
InChIKey CQIZWZSAHHTJHH-UHFFFAOYSA-N
Molecular Weight 243.306 g/mol
SMILES C(N(CC=1OC=CC1)C(C)=O)(C)C1=CC=CC=C1