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Methyl 6-[Chloro(difluoro)methyl]-2-hydroxy-4-methyl-3-octylbenzoate
SpectraBase Compound ID Fc7TLj1iuxE
InChI InChI=1S/C18H25ClF2O3/c1-4-5-6-7-8-9-10-13-12(2)11-14(18(19,20)21)15(16(13)22)17(23)24-3/h11,22H,4-10H2,1-3H3
InChIKey XQUUFZSYJWRSIW-UHFFFAOYSA-N
Mol Weight 362.84 g/mol
Molecular Formula C18H25ClF2O3
Exact Mass 362.146029 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7OuSLj8WcZO
Name Methyl 6-[Chloro(difluoro)methyl]-2-hydroxy-4-methyl-3-octylbenzoate
Alternate Name(s) Methyl 6-(chlorodifluoromethyl)-2-hydroxy-4-methyl-3-octylbenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H25ClF2O3
InChI InChI=1S/C18H25ClF2O3/c1-4-5-6-7-8-9-10-13-12(2)11-14(18(19,20)21)15(16(13)22)17(23)24-3/h11,22H,4-10H2,1-3H3
InChIKey XQUUFZSYJWRSIW-UHFFFAOYSA-N
Molecular Weight 362.845 g/mol
SMILES Oc1c(C(=O)OC)c(cc(c1CCCCCCCC)C)C(F)(F)Cl
SPLASH splash10-02t9-0189000000-d80226420b3fb0eefdf3
Source of Spectrum H-95-1044-3p
Wiley ID 1784319