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1,4,7,10-Tetraoxa-13-(N-phenylphthalamyl)azacyclopentadecane
SpectraBase Compound ID DW2nHKyCqy
InChI InChI=1S/C24H30N2O6/c27-23(25-20-6-2-1-3-7-20)21-8-4-5-9-22(21)24(28)26-10-12-29-14-16-31-18-19-32-17-15-30-13-11-26/h1-9H,10-19H2,(H,25,27)
InChIKey AXCMIUMDSDEWTL-UHFFFAOYSA-N
Mol Weight 442.51 g/mol
Molecular Formula C24H30N2O6
Exact Mass 442.210387 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hn3HqLw0MbZ
Name 1,4,7,10-Tetraoxa-13-(N-phenylphthalamyl)azacyclopentadecane
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 442.210386688 u
Formula C24H30N2O6
InChI InChI=1S/C24H30N2O6/c27-23(25-20-6-2-1-3-7-20)21-8-4-5-9-22(21)24(28)26-10-12-29-14-16-31-18-19-32-17-15-30-13-11-26/h1-9H,10-19H2,(H,25,27)
InChIKey AXCMIUMDSDEWTL-UHFFFAOYSA-N
Molecular Weight 442.512 g/mol
SMILES C1COCCOCCOCCN(C(=O)C2=CC=CC=C2C(NC2=CC=CC=C2)=O)CCO1