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2H-1-benzopyran-2-one, 4-butyl-7-[(4-fluorophenyl)methoxy]-8-methyl-

View entire compound with spectra: 2 NMR

2H-1-benzopyran-2-one, 4-butyl-7-[(4-fluorophenyl)methoxy]-8-methyl-
SpectraBase Compound ID KSHiDH7dBVP
InChI InChI=1S/C21H21FO3/c1-3-4-5-16-12-20(23)25-21-14(2)19(11-10-18(16)21)24-13-15-6-8-17(22)9-7-15/h6-12H,3-5,13H2,1-2H3
InChIKey TZPBRURLVMETKJ-UHFFFAOYSA-N
Mol Weight 340.39 g/mol
Molecular Formula C21H21FO3
Exact Mass 340.147473 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7BlsT47xKN7
Name 2H-1-Benzopyran-2-one, 4-butyl-7-[(4-fluorophenyl)methoxy]-8-methyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 340.147472696 u
Formula C21H21FO3
InChI InChI=1S/C21H21FO3/c1-3-4-5-16-12-20(23)25-21-14(2)19(11-10-18(16)21)24-13-15-6-8-17(22)9-7-15/h6-12H,3-5,13H2,1-2H3
InChIKey TZPBRURLVMETKJ-UHFFFAOYSA-N
Molecular Weight 340.394 g/mol
SMILES C=12C(C(CCCC)=CC(O2)=O)=CC=C(C1C)OCC=1C=CC(=CC1)F