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2-[1,1'-Biphenyl]-4-yl-2-oxoethyl 2-hydroxybutanoate
SpectraBase Compound ID CHE8bsgwIml
InChI InChI=1S/C18H18O4/c1-2-16(19)18(21)22-12-17(20)15-10-8-14(9-11-15)13-6-4-3-5-7-13/h3-11,16,19H,2,12H2,1H3
InChIKey UUICCPBJHDRZSS-UHFFFAOYSA-N
Mol Weight 298.34 g/mol
Molecular Formula C18H18O4
Exact Mass 298.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EZASw5edxqV
Name 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl 2-hydroxybutanoate
Alternate Name(s) 2-Hydroxybutanoic acid, 2-(1,1-biphenyl-4-yl)-2-oxoethyl ester 2-Hydroxybutanoic acid [2-oxo-2-(4-phenylphenyl)ethyl] ester [2-oxo-2-(4-phenylphenyl)ethyl] 2-hydroxybutanoate [2-oxidanylidene-2-(4-phenylphenyl)ethyl] 2-oxidanylbutanoate
Comments Note: The molecular formula of the structure shown is C18H18O4 - which differs from the formula reported for the mass spectrum (C18H16D2O4)
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Formula C18H16D2O4
InChI InChI=1S/C18H18O4/c1-2-16(19)18(21)22-12-17(20)15-10-8-14(9-11-15)13-6-4-3-5-7-13/h3-11,16,19H,2,12H2,1H3
InChIKey UUICCPBJHDRZSS-UHFFFAOYSA-N
Molecular Weight 298.338 g/mol
SMILES OC(C(OCC(c1ccc(-c2ccccc2)cc1)=O)=O)CC
SPLASH splash10-001i-2900000000-ca1ab436258f5c902f7b
Wiley ID 1478286