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2H-Pyran-3(6H)-one, 6-(benzoyloxy)-6-[(phenylmethoxy)methyl]-, (.+-.)-
SpectraBase Compound ID 3oaOQAkRP0v
InChI InChI=1S/C20H18O5/c21-18-11-12-20(24-14-18,15-23-13-16-7-3-1-4-8-16)25-19(22)17-9-5-2-6-10-17/h1-12H,13-15H2
InChIKey WWTLLHBCEXVEDG-UHFFFAOYSA-N
Mol Weight 338.36 g/mol
Molecular Formula C20H18O5
Exact Mass 338.115424 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GakXi2XjCLQ
Name 2H-Pyran-3(6H)-one, 6-(benzoyloxy)-6-[(phenylmethoxy)methyl]-, (.+-.)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 338.115423675 u
Formula C20H18O5
InChI InChI=1S/C20H18O5/c21-18-11-12-20(24-14-18,15-23-13-16-7-3-1-4-8-16)25-19(22)17-9-5-2-6-10-17/h1-12H,13-15H2
InChIKey WWTLLHBCEXVEDG-UHFFFAOYSA-N
Molecular Weight 338.359 g/mol
SMILES C(OC1(OCC(C=C1)=O)COCC=1C=CC=CC1)(=O)C1=CC=CC=C1