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(2R)-2-m-anisylbutyric acid methyl ester
SpectraBase Compound ID 7dxo90B48Wr
InChI InChI=1S/C13H18O3/c1-4-11(13(14)16-3)8-10-6-5-7-12(9-10)15-2/h5-7,9,11H,4,8H2,1-3H3/t11-/m1/s1
InChIKey JFVCTUYBEURQPE-LLVKDONJSA-N
Mol Weight 222.28 g/mol
Molecular Formula C13H18O3
Exact Mass 222.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4zAtFPSjPi6
Name (2R)-2-m-anisylbutyric acid methyl ester
Alternate Name(s) (2R)-2-[(3-methoxyphenyl)methyl]butanoic acid methyl ester methyl (2R)-2-[(3-methoxyphenyl)methyl]butanoate
Comments Less than 3 mono-isotopic peaks
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Formula C13H18O3
InChI InChI=1S/C13H18O3/c1-4-11(13(14)16-3)8-10-6-5-7-12(9-10)15-2/h5-7,9,11H,4,8H2,1-3H3/t11-/m1/s1
InChIKey JFVCTUYBEURQPE-LLVKDONJSA-N
Molecular Weight 222.284 g/mol
SMILES C([C@](CC)(Cc1cc(ccc1)OC)[H])(=O)OC
SPLASH splash10-0229-0590000000-3ff239d3ee45306d93ca
Source of Spectrum F2-42-2465-7
Wiley ID 1600256