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Methyl 2-[2-Oxobutyl-4-(4'-methoxyphenyl)]benzoate isomer
SpectraBase Compound ID BerVWPfv8SZ
InChI InChI=1S/C19H20O4/c1-22-17-11-8-14(9-12-17)7-10-16(20)13-15-5-3-4-6-18(15)19(21)23-2/h3-6,8-9,11-12H,7,10,13H2,1-2H3
InChIKey GYYPUZHCTDQFCY-UHFFFAOYSA-N
Mol Weight 312.37 g/mol
Molecular Formula C19H20O4
Exact Mass 312.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lfkun7OXkaM
Name Methyl 2-[2-Oxobutyl-4-(4'-methoxyphenyl)]benzoate isomer
Alternate Name(s) Methyl 2-[2-Oxobutyl-(4'-methoxyphenyl)]benzoate isomer Methyl 2-[4-(4-methoxyphenyl)-2-oxobutyl]benzoate
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Formula C19H20O4
InChI InChI=1S/C19H20O4/c1-22-17-11-8-14(9-12-17)7-10-16(20)13-15-5-3-4-6-18(15)19(21)23-2/h3-6,8-9,11-12H,7,10,13H2,1-2H3
InChIKey GYYPUZHCTDQFCY-UHFFFAOYSA-N
Molecular Weight 312.365 g/mol
SMILES C(c1c(CC(=O)CCc2ccc(cc2)OC)cccc1)(=O)OC
SPLASH splash10-00lr-0790000000-7fd4cccac8f445dc0719
Source of Spectrum Y1-37-481-4
Wiley ID 1527370