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Methyl 3-(6-Chlorohexyl)-2-hydroxy-4-methyl-6-(trifluoromethyl)benzoate
SpectraBase Compound ID E67avngUebi
InChI InChI=1S/C16H20ClF3O3/c1-10-9-12(16(18,19)20)13(15(22)23-2)14(21)11(10)7-5-3-4-6-8-17/h9,21H,3-8H2,1-2H3
InChIKey MNEMDWIINMQPOA-UHFFFAOYSA-N
Mol Weight 352.78 g/mol
Molecular Formula C16H20ClF3O3
Exact Mass 352.105307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8jvHnhPwiyK
Name Methyl 3-(6-Chlorohexyl)-2-hydroxy-4-methyl-6-(trifluoromethyl)benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20ClF3O3
InChI InChI=1S/C16H20ClF3O3/c1-10-9-12(16(18,19)20)13(15(22)23-2)14(21)11(10)7-5-3-4-6-8-17/h9,21H,3-8H2,1-2H3
InChIKey MNEMDWIINMQPOA-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.201200056
Molecular Weight 352.781 g/mol
SMILES Oc1c(C(=O)OC)c(cc(C)c1CCCCCCCl)C(F)(F)F
SPLASH splash10-066r-0396000000-6723d57dafb826d0c7ed
Source of Spectrum H-96-51-5f
Wiley ID 1784510