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2-Methyl-butyric acid 1-phenyl-ethyl ester
SpectraBase Compound ID BMAkcPKGBbR
InChI InChI=1S/C13H18O2/c1-4-10(2)13(14)15-11(3)12-8-6-5-7-9-12/h5-11H,4H2,1-3H3
InChIKey KOQHMJIFZXCPNR-UHFFFAOYSA-N
Mol Weight 206.28 g/mol
Molecular Formula C13H18O2
Exact Mass 206.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GtC3GdsgX0g
Name 2-Methyl-butyric acid 1-phenyl-ethyl ester
Alternate Name(s) {R}-1-(Phenylethyl)[S}-2-Methylbutanoate 2-Methylbutanoic acid 1-phenylethyl ester 1-Phenylethyl 2-methylbutanoate
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Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-4-10(2)13(14)15-11(3)12-8-6-5-7-9-12/h5-11H,4H2,1-3H3
InChIKey KOQHMJIFZXCPNR-UHFFFAOYSA-N
Molecular Weight 206.285 g/mol
SMILES C(OC(c1ccccc1)C)(=O)C(CC)C
SPLASH splash10-0a4i-3900000000-ce5ccec8d416fe3092dc
Source of Spectrum G4-71-2003-F
Wiley ID 1695119