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Ethyl 6-[Chloro(difluoro)methyl]-2-hydroxy-4-methyl-3-(1-methylethyl)benzoate
SpectraBase Compound ID 8wMb8aYLirJ
InChI InChI=1S/C14H17ClF2O3/c1-5-20-13(19)11-9(14(15,16)17)6-8(4)10(7(2)3)12(11)18/h6-7,18H,5H2,1-4H3
InChIKey KJIDDSAKMRDACW-UHFFFAOYSA-N
Mol Weight 306.74 g/mol
Molecular Formula C14H17ClF2O3
Exact Mass 306.083428 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Woska4qEQ1
Name Ethyl 6-[Chloro(difluoro)methyl]-2-hydroxy-4-methyl-3-(1-methylethyl)benzoate
Alternate Name(s) Ethyl 6-(chlorodifluoromethyl)-2-hydroxy-3-isopropyl-4-methylbenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17ClF2O3
InChI InChI=1S/C14H17ClF2O3/c1-5-20-13(19)11-9(14(15,16)17)6-8(4)10(7(2)3)12(11)18/h6-7,18H,5H2,1-4H3
InChIKey KJIDDSAKMRDACW-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.201100494
Molecular Weight 306.737 g/mol
SMILES Oc1c(C(=O)OCC)c(cc(c1C(C)C)C)C(F)(F)Cl
SPLASH splash10-022a-0191000000-6235ca013d6430ed723c
Source of Spectrum H-95-1043-3k
Wiley ID 1784314