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4-Methyl-4'-(p-1,4,7,10-tetraoxa-13-azacyclopentadecan-13-ylstyryl)-2,2'-bipyridine

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4-Methyl-4'-(p-1,4,7,10-tetraoxa-13-azacyclopentadecan-13-ylstyryl)-2,2'-bipyridine
SpectraBase Compound ID AFdU9YQO9MO
InChI InChI=1S/C29H35N3O4/c1-24-8-10-30-28(22-24)29-23-26(9-11-31-29)3-2-25-4-6-27(7-5-25)32-12-14-33-16-18-35-20-21-36-19-17-34-15-13-32/h2-11,22-23H,12-21H2,1H3/b3-2+
InChIKey LCGWQLHFZNXNQU-NSCUHMNNSA-N
Mol Weight 489.6 g/mol
Molecular Formula C29H35N3O4
Exact Mass 489.262757 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3xFZUmPTVVp
Name 4-Methyl-4'-(p-1,4,7,10-tetraoxa-13-azacyclopentadecan-13-ylstyryl)-2,2'-bipyridine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 489.262756615 u
Formula C29H35N3O4
InChI InChI=1S/C29H35N3O4/c1-24-8-10-30-28(22-24)29-23-26(9-11-31-29)3-2-25-4-6-27(7-5-25)32-12-14-33-16-18-35-20-21-36-19-17-34-15-13-32/h2-11,22-23H,12-21H2,1H3/b3-2+
InChIKey LCGWQLHFZNXNQU-NSCUHMNNSA-N
Molecular Weight 489.616 g/mol
SMILES C1(N2CCOCCOCCOCCOCC2)=CC=C(\C=C\C2=CC(C3=NC=CC(=C3)C)=NC=C2)C=C1