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5-(11-Oxoundec-1-ynyl)-1,10-phenanthroline
SpectraBase Compound ID JwRxA5UC3iE
InChI InChI=1S/C23H24N2O/c26-17-9-7-5-3-1-2-4-6-8-12-19-18-20-13-10-15-24-22(20)23-21(19)14-11-16-25-23/h10-11,13-18H,1-7,9H2
InChIKey ZRAIFAUEDNXACL-UHFFFAOYSA-N
Mol Weight 344.46 g/mol
Molecular Formula C23H24N2O
Exact Mass 344.188863 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8fj30Akk10n
Name 5-(11-Oxoundec-1-ynyl)-1,10-phenanthroline
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 344.188863400 u
Formula C23H24N2O
InChI InChI=1S/C23H24N2O/c26-17-9-7-5-3-1-2-4-6-8-12-19-18-20-13-10-15-24-22(20)23-21(19)14-11-16-25-23/h10-11,13-18H,1-7,9H2
InChIKey ZRAIFAUEDNXACL-UHFFFAOYSA-N
Molecular Weight 344.458 g/mol
SMILES C1=2C=3C(=CC=CN3)C=C(C1=CC=CN2)C#CCCCCCCCCC=O