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Acetic acid, trifluoro-, (9,10-dihydro-1-methoxy-9,10-dioxo-2-anthracenyl)methyl ester

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

Acetic acid, trifluoro-, (9,10-dihydro-1-methoxy-9,10-dioxo-2-anthracenyl)methyl ester
SpectraBase Compound ID CbhhwNSJ0Wp
InChI InChI=1S/C18H11F3O5/c1-25-16-9(8-26-17(24)18(19,20)21)6-7-12-13(16)15(23)11-5-3-2-4-10(11)14(12)22/h2-7H,8H2,1H3
InChIKey CTJPEKLEFNPRSY-UHFFFAOYSA-N
Mol Weight 364.28 g/mol
Molecular Formula C18H11F3O5
Exact Mass 364.055858 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BjFAEuGeMYd
Name Acetic acid, trifluoro-, (9,10-dihydro-1-methoxy-9,10-dioxo-2-anthracenyl)methyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 364.055857938 u
Formula C18H11F3O5
InChI InChI=1S/C18H11F3O5/c1-25-16-9(8-26-17(24)18(19,20)21)6-7-12-13(16)15(23)11-5-3-2-4-10(11)14(12)22/h2-7H,8H2,1H3
InChIKey CTJPEKLEFNPRSY-UHFFFAOYSA-N
Molecular Weight 364.276 g/mol
SMILES C=12C(C=3C=CC=CC3C(C2=CC=C(C1OC)COC(C(F)(F)F)=O)=O)=O