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2H-1-Benzopyran-2-one, 5,7-bis(acetyloxy)-4-[4-(acetyloxy)phenyl]-
SpectraBase Compound ID 67qbBajjWjE
InChI InChI=1S/C21H16O8/c1-11(22)26-15-6-4-14(5-7-15)17-10-20(25)29-19-9-16(27-12(2)23)8-18(21(17)19)28-13(3)24/h4-10H,1-3H3
InChIKey ABPAECXMPXPVMR-UHFFFAOYSA-N
Mol Weight 396.35 g/mol
Molecular Formula C21H16O8
Exact Mass 396.084517 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FdDWoX7VOkG
Name 2H-1-Benzopyran-2-one, 5,7-bis(acetyloxy)-4-[4-(acetyloxy)phenyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 396.084517467 u
Formula C21H16O8
InChI InChI=1S/C21H16O8/c1-11(22)26-15-6-4-14(5-7-15)17-10-20(25)29-19-9-16(27-12(2)23)8-18(21(17)19)28-13(3)24/h4-10H,1-3H3
InChIKey ABPAECXMPXPVMR-UHFFFAOYSA-N
Molecular Weight 396.351 g/mol
SMILES C=1(C=2C(=CC(=CC2OC(=O)C)OC(=O)C)OC(C1)=O)C1=CC=C(OC(=O)C)C=C1