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Methyl 2,2-dimethyl-5-phenyl-3-(N-phenylamino)-4-pentenoate
SpectraBase Compound ID A2np5bvrIy8
InChI InChI=1S/C20H23NO2/c1-20(2,19(22)23-3)18(21-17-12-8-5-9-13-17)15-14-16-10-6-4-7-11-16/h4-15,18,21H,1-3H3/b15-14+
InChIKey HBXIMLXEJUHMNY-CCEZHUSRSA-N
Mol Weight 309.41 g/mol
Molecular Formula C20H23NO2
Exact Mass 309.172879 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DSLlBBIuXRK
Name Methyl 2,2-dimethyl-5-phenyl-3-(N-phenylamino)-4-pentenoate
Comments Computed using HOSE algorithm
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Exact Mass 309.172878983 u
Formula C20H23NO2
InChI InChI=1S/C20H23NO2/c1-20(2,19(22)23-3)18(21-17-12-8-5-9-13-17)15-14-16-10-6-4-7-11-16/h4-15,18,21H,1-3H3/b15-14+
InChIKey HBXIMLXEJUHMNY-CCEZHUSRSA-N
Molecular Weight 309.409 g/mol
SMILES C(C)(C)(C(=O)OC)C(NC=1C=CC=CC1)\C=C\C1=CC=CC=C1