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2-[2,6-bis(hex-5-Enoxy)phenyl]-9-chloranyl-1,10-phenanthroline

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2-[2,6-bis(hex-5-Enoxy)phenyl]-9-chloranyl-1,10-phenanthroline
SpectraBase Compound ID LdWfLnO0HYu
InChI InChI=1S/C30H31ClN2O2/c1-3-5-7-9-20-34-25-12-11-13-26(35-21-10-8-6-4-2)28(25)24-18-16-22-14-15-23-17-19-27(31)33-30(23)29(22)32-24/h3-4,11-19H,1-2,5-10,20-21H2
InChIKey ORIOMIOZYRYXRD-UHFFFAOYSA-N
Mol Weight 487.04 g/mol
Molecular Formula C30H31ClN2O2
Exact Mass 486.207406 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2c3Fw5eVbJQ
Name 2-[2,6-bis(hex-5-Enoxy)phenyl]-9-chloranyl-1,10-phenanthroline
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 486.207405944 u
Formula C30H31ClN2O2
InChI InChI=1S/C30H31ClN2O2/c1-3-5-7-9-20-34-25-12-11-13-26(35-21-10-8-6-4-2)28(25)24-18-16-22-14-15-23-17-19-27(31)33-30(23)29(22)32-24/h3-4,11-19H,1-2,5-10,20-21H2
InChIKey ORIOMIOZYRYXRD-UHFFFAOYSA-N
Molecular Weight 487.043 g/mol
SMILES C=12C(C=CC3=CC=C(N=C23)C=2C(=CC=CC2OCCCCC=C)OCCCCC=C)=CC=C(N1)Cl