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Methyl 3-Benzyl-2-hydroxy-4-methyl-6-(trifluoromethyl)benzoate
SpectraBase Compound ID Itr9XsUkmtE
InChI InChI=1S/C17H15F3O3/c1-10-8-13(17(18,19)20)14(16(22)23-2)15(21)12(10)9-11-6-4-3-5-7-11/h3-8,21H,9H2,1-2H3
InChIKey CVCZVTXJTDVOQJ-UHFFFAOYSA-N
Mol Weight 324.3 g/mol
Molecular Formula C17H15F3O3
Exact Mass 324.097329 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EoHIRCSu2vM
Name Methyl 3-Benzyl-2-hydroxy-4-methyl-6-(trifluoromethyl)benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15F3O3
InChI InChI=1S/C17H15F3O3/c1-10-8-13(17(18,19)20)14(16(22)23-2)15(21)12(10)9-11-6-4-3-5-7-11/h3-8,21H,9H2,1-2H3
InChIKey CVCZVTXJTDVOQJ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.201200056
Molecular Weight 324.299 g/mol
SMILES Oc1c(C(=O)OC)c(cc(C)c1Cc1ccccc1)C(F)(F)F
SPLASH splash10-02ml-0091000000-d834bdaab6ba5e260d96
Source of Spectrum H-96-52-5j
Wiley ID 1784513