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(phenylmethyl) N-(3-fluoranyl-4-pyridin-4-yl-phenyl)carbamate
SpectraBase Compound ID 3JjPqbmctkW
InChI InChI=1S/C19H15FN2O2/c20-18-12-16(6-7-17(18)15-8-10-21-11-9-15)22-19(23)24-13-14-4-2-1-3-5-14/h1-12H,13H2,(H,22,23)
InChIKey QGZBATKGIJWMNN-UHFFFAOYSA-N
Mol Weight 322.34 g/mol
Molecular Formula C19H15FN2O2
Exact Mass 322.111756 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5k5hb4yqqVL
Name (Phenylmethyl) N-(3-fluoranyl-4-pyridin-4-yl-phenyl)carbamate
Comments Computed using HOSE algorithm
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Exact Mass 322.111755892 u
Formula C19H15FN2O2
InChI InChI=1S/C19H15FN2O2/c20-18-12-16(6-7-17(18)15-8-10-21-11-9-15)22-19(23)24-13-14-4-2-1-3-5-14/h1-12H,13H2,(H,22,23)
InChIKey QGZBATKGIJWMNN-UHFFFAOYSA-N
Molecular Weight 322.339 g/mol
SMILES C(NC=1C=C(F)C(=CC1)C=1C=CN=CC1)(=O)OCC=1C=CC=CC1