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2-Hydroxy-5-methoxybenzoic acid, o-trifluoroacetyl-, 2,2,3,3-tetrafluoro-1-propyl ester

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2-Hydroxy-5-methoxybenzoic acid, o-trifluoroacetyl-, 2,2,3,3-tetrafluoro-1-propyl ester
SpectraBase Compound ID LY4fSX3ko7U
InChI InChI=1S/C13H9F7O5/c1-23-6-2-3-8(25-11(22)13(18,19)20)7(4-6)9(21)24-5-12(16,17)10(14)15/h2-4,10H,5H2,1H3
InChIKey HDYQVDXKWSFDQY-UHFFFAOYSA-N
Mol Weight 378.2 g/mol
Molecular Formula C13H9F7O5
Exact Mass 378.033821 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8Jh7Ek2T2Fc
Name 2-Hydroxy-5-methoxybenzoic acid, o-trifluoroacetyl-, 2,2,3,3-tetrafluoro-1-propyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 378.033820526 u
Formula C13H9F7O5
InChI InChI=1S/C13H9F7O5/c1-23-6-2-3-8(25-11(22)13(18,19)20)7(4-6)9(21)24-5-12(16,17)10(14)15/h2-4,10H,5H2,1H3
InChIKey HDYQVDXKWSFDQY-UHFFFAOYSA-N
Molecular Weight 378.199 g/mol
SMILES C1(=CC=C(C(=C1)C(=O)OCC(C(F)F)(F)F)OC(C(F)(F)F)=O)OC