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Methyl 3-(3-Chloropropyl)-2-hydroxy-4-methyl-6-(trifluoromethyl)benzoate
SpectraBase Compound ID 3A5Ys8wHtnm
InChI InChI=1S/C13H14ClF3O3/c1-7-6-9(13(15,16)17)10(12(19)20-2)11(18)8(7)4-3-5-14/h6,18H,3-5H2,1-2H3
InChIKey FIQPHDNEOJLDPC-UHFFFAOYSA-N
Mol Weight 310.7 g/mol
Molecular Formula C13H14ClF3O3
Exact Mass 310.058356 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 73ISaoSFPrm
Name Methyl 3-(3-Chloropropyl)-2-hydroxy-4-methyl-6-(trifluoromethyl)benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14ClF3O3
InChI InChI=1S/C13H14ClF3O3/c1-7-6-9(13(15,16)17)10(12(19)20-2)11(18)8(7)4-3-5-14/h6,18H,3-5H2,1-2H3
InChIKey FIQPHDNEOJLDPC-UHFFFAOYSA-N
Molecular Weight 310.700 g/mol
SMILES Oc1c(C(=O)OC)c(C(F)(F)F)cc(C)c1CCCCl
SPLASH splash10-0006-0191000000-b880edbdeb6f53afce4a
Source of Spectrum H-96-51-5c
Wiley ID 1784507