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6-Ethyl-7-hydroxy-4-phenyl-2H-1-benzopyran-2-one, trimethylacetate

View entire compound with spectra: 1 NMR, and 1 FTIR

6-Ethyl-7-hydroxy-4-phenyl-2H-1-benzopyran-2-one, trimethylacetate
SpectraBase Compound ID 5qMyZma4HDQ
InChI InChI=1S/C22H22O4/c1-5-14-11-17-16(15-9-7-6-8-10-15)12-20(23)25-19(17)13-18(14)26-21(24)22(2,3)4/h6-13H,5H2,1-4H3
InChIKey CDMCGVLESRMJAO-UHFFFAOYSA-N
Mol Weight 350.41 g/mol
Molecular Formula C22H22O4
Exact Mass 350.151809 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Kar8J5jA9if
Name 6-Ethyl-7-hydroxy-4-phenyl-2H-1-benzopyran-2-one, trimethylacetate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 350.151809184 u
Formula C22H22O4
InChI InChI=1S/C22H22O4/c1-5-14-11-17-16(15-9-7-6-8-10-15)12-20(23)25-19(17)13-18(14)26-21(24)22(2,3)4/h6-13H,5H2,1-4H3
InChIKey CDMCGVLESRMJAO-UHFFFAOYSA-N
Molecular Weight 350.414 g/mol
SMILES C1=2OC(C=C(C2C=C(C(=C1)OC(C(C)(C)C)=O)CC)C1=CC=CC=C1)=O