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3-(4-Phenoxybutoxy)-2-phenyl-4H-[1]benzopyran-4-one

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

3-(4-Phenoxybutoxy)-2-phenyl-4H-[1]benzopyran-4-one
SpectraBase Compound ID yvm398ram
InChI InChI=1S/C25H22O4/c26-23-21-15-7-8-16-22(21)29-24(19-11-3-1-4-12-19)25(23)28-18-10-9-17-27-20-13-5-2-6-14-20/h1-8,11-16H,9-10,17-18H2
InChIKey RIBSFWHNIYARCH-UHFFFAOYSA-N
Mol Weight 386.45 g/mol
Molecular Formula C25H22O4
Exact Mass 386.151809 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J7XT7leKV7z
Name 3-(4-Phenoxybutoxy)-2-phenyl-4H-[1]benzopyran-4-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 386.151809184 u
Formula C25H22O4
InChI InChI=1S/C25H22O4/c26-23-21-15-7-8-16-22(21)29-24(19-11-3-1-4-12-19)25(23)28-18-10-9-17-27-20-13-5-2-6-14-20/h1-8,11-16H,9-10,17-18H2
InChIKey RIBSFWHNIYARCH-UHFFFAOYSA-N
Molecular Weight 386.447 g/mol
SMILES C1(=C(C(C=2C(O1)=CC=CC2)=O)OCCCCOC=1C=CC=CC1)C=1C=CC=CC1