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7-Benzyloxy-8-(formylmethyl)-5-methoxy-2-methylchroman-4-one

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

7-Benzyloxy-8-(formylmethyl)-5-methoxy-2-methylchroman-4-one
SpectraBase Compound ID Ds9Kep6bx5o
InChI InChI=1S/C20H20O5/c1-13-10-16(22)19-18(23-2)11-17(15(8-9-21)20(19)25-13)24-12-14-6-4-3-5-7-14/h3-7,9,11,13H,8,10,12H2,1-2H3
InChIKey LPWILRXJYKUHOP-UHFFFAOYSA-N
Mol Weight 340.38 g/mol
Molecular Formula C20H20O5
Exact Mass 340.131074 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8DpKmsO9uEW
Name 7-Benzyloxy-8-(formylmethyl)-5-methoxy-2-methylchroman-4-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 340.131073739 u
Formula C20H20O5
InChI InChI=1S/C20H20O5/c1-13-10-16(22)19-18(23-2)11-17(15(8-9-21)20(19)25-13)24-12-14-6-4-3-5-7-14/h3-7,9,11,13H,8,10,12H2,1-2H3
InChIKey LPWILRXJYKUHOP-UHFFFAOYSA-N
Molecular Weight 340.375 g/mol
SMILES C12=C(C(CC=O)=C(C=C2OC)OCC=2C=CC=CC2)OC(CC1=O)C