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3-Allyloxycarbonyl-3-phenyl-chroman-4-one

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

3-Allyloxycarbonyl-3-phenyl-chroman-4-one
SpectraBase Compound ID C2Eg0N5NiYC
InChI InChI=1S/C19H16O4/c1-2-12-22-18(21)19(14-8-4-3-5-9-14)13-23-16-11-7-6-10-15(16)17(19)20/h2-11H,1,12-13H2
InChIKey LQLAQTMHIXFROM-UHFFFAOYSA-N
Mol Weight 308.33 g/mol
Molecular Formula C19H16O4
Exact Mass 308.104859 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FoED9mOy2mH
Name 3-Allyloxycarbonyl-3-phenyl-chroman-4-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 308.104858991 u
Formula C19H16O4
InChI InChI=1S/C19H16O4/c1-2-12-22-18(21)19(14-8-4-3-5-9-14)13-23-16-11-7-6-10-15(16)17(19)20/h2-11H,1,12-13H2
InChIKey LQLAQTMHIXFROM-UHFFFAOYSA-N
SMILES C1OC2=CC=CC=C2C(C1(C(=O)OCC=C)C1=CC=CC=C1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.969596