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2-[(5-hydroxy-2,2-dimethyl-4-oxo-3,4-dihydro-2H-chromen-7-yl)oxy]-N-[4-(4-methyl-1-piperidinyl)phenyl]acetamide
SpectraBase Compound ID AahCMHdSy4J
InChI InChI=1S/C25H30N2O5/c1-16-8-10-27(11-9-16)18-6-4-17(5-7-18)26-23(30)15-31-19-12-20(28)24-21(29)14-25(2,3)32-22(24)13-19/h4-7,12-13,16,28H,8-11,14-15H2,1-3H3,(H,26,30)
InChIKey IXEATDSXBZOSIP-UHFFFAOYSA-N
Mol Weight 438.52 g/mol
Molecular Formula C25H30N2O5
Exact Mass 438.215472 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J5Ux8goOxDH
Name 2-[(5-Hydroxy-2,2-dimethyl-4-oxo-3,4-dihydro-2H-chromen-7-yl)oxy]-N-[4-(4-methyl-1-piperidinyl)phenyl]acetamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 438.215472069 u
Formula C25H30N2O5
InChI InChI=1S/C25H30N2O5/c1-16-8-10-27(11-9-16)18-6-4-17(5-7-18)26-23(30)15-31-19-12-20(28)24-21(29)14-25(2,3)32-22(24)13-19/h4-7,12-13,16,28H,8-11,14-15H2,1-3H3,(H,26,30)
InChIKey IXEATDSXBZOSIP-UHFFFAOYSA-N
Molecular Weight 438.524 g/mol
SMILES OC=1C=C(OCC(NC2=CC=C(N3CCC(CC3)C)C=C2)=O)C=C2OC(CC(C12)=O)(C)C