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3-Methylbutyl 2-[Chloro(difluoro)methyl]-6-hydroxy-4-methylbenzoate
SpectraBase Compound ID 32952eP27o3
InChI InChI=1S/C14H17ClF2O3/c1-8(2)4-5-20-13(19)12-10(14(15,16)17)6-9(3)7-11(12)18/h6-8,18H,4-5H2,1-3H3
InChIKey UYRZZENFPKAVNJ-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 LKhjHMd2qog
Name 3-Methylbutyl 2-[Chloro(difluoro)methyl]-6-hydroxy-4-methylbenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17ClF2O3
InChI InChI=1S/C14H17ClF2O3/c1-8(2)4-5-20-13(19)12-10(14(15,16)17)6-9(3)7-11(12)18/h6-8,18H,4-5H2,1-3H3
InChIKey UYRZZENFPKAVNJ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.201100494
Molecular Weight 306.737 g/mol
SMILES Oc1cc(cc(c1C(=O)OCCC(C)C)C(F)(F)Cl)C
SPLASH splash10-01b9-2191000000-cdee29d01b7e2e602cb4
Source of Spectrum H-95-1042-3d
Synonyms isopentyl 2-(chlorodifluoromethyl)-6-hydroxy-4-methylbenzoate
Wiley ID 1784307