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2,13,24-Trioxa-10,16-diaza-9,10,6,17-dieno-2,9,17,24(1,2)diphenyl-1,25(2,6)pyridinophane

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2,13,24-Trioxa-10,16-diaza-9,10,6,17-dieno-2,9,17,24(1,2)diphenyl-1,25(2,6)pyridinophane
SpectraBase Compound ID 8FC0O61Rjog
InChI InChI=1S/C25H25N3O3/c1-3-10-24-20(6-1)16-26-12-14-29-15-13-27-17-21-7-2-4-11-25(21)31-19-23-9-5-8-22(28-23)18-30-24/h1-11,16-17H,12-15,18-19H2
InChIKey DSHVOUCGIOLILK-UHFFFAOYSA-N
Mol Weight 415.49 g/mol
Molecular Formula C25H25N3O3
Exact Mass 415.189592 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9QCu1gAW6JX
Name 2,13,24-Trioxa-10,16-diaza-9,10,6,17-dieno-2,9,17,24(1,2)diphenyl-1,25(2,6)pyridinophane
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 415.189591674 u
Formula C25H25N3O3
InChI InChI=1S/C25H25N3O3/c1-3-10-24-20(6-1)16-26-12-14-29-15-13-27-17-21-7-2-4-11-25(21)31-19-23-9-5-8-22(28-23)18-30-24/h1-11,16-17H,12-15,18-19H2
InChIKey DSHVOUCGIOLILK-UHFFFAOYSA-N
Molecular Weight 415.493 g/mol
SMILES C1=2OCC=3C=CC=C(COC4=C(C=NCCOCCN=CC2C=CC=C1)C=CC=C4)N3