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Benzenethanamine, 4,5-dibenzyloxy-2-fluoro-.beta.-hydroxy-

View entire compound with spectra: 1 NMR, and 1 FTIR

Benzenethanamine, 4,5-dibenzyloxy-2-fluoro-.beta.-hydroxy-
SpectraBase Compound ID IErUTyO0Qzi
InChI InChI=1S/C22H22FNO3/c23-19-12-22(27-15-17-9-5-2-6-10-17)21(11-18(19)20(25)13-24)26-14-16-7-3-1-4-8-16/h1-12,20,25H,13-15,24H2
InChIKey HNOPMGQPKHBDRQ-UHFFFAOYSA-N
Mol Weight 367.42 g/mol
Molecular Formula C22H22FNO3
Exact Mass 367.158372 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9ZykM2ujGng
Name Benzenethanamine, 4,5-dibenzyloxy-2-fluoro-.beta.-hydroxy-
Comments Computed using HOSE algorithm
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Exact Mass 367.158371732 u
Formula C22H22FNO3
InChI InChI=1S/C22H22FNO3/c23-19-12-22(27-15-17-9-5-2-6-10-17)21(11-18(19)20(25)13-24)26-14-16-7-3-1-4-8-16/h1-12,20,25H,13-15,24H2
InChIKey HNOPMGQPKHBDRQ-UHFFFAOYSA-N
Molecular Weight 367.420 g/mol
SMILES C1(=C(C=C(C(=C1)OCC1=CC=CC=C1)OCC1=CC=CC=C1)C(CN)O)F