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Methyl (S)-3-Methyl-4-phenylbutanoate
SpectraBase Compound ID BuyEDwYlEp1
InChI InChI=1S/C12H16O2/c1-10(9-12(13)14-2)8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3/t10-/m0/s1
InChIKey UIXSBHVUQGNCHV-JTQLQIEISA-N
Mol Weight 192.26 g/mol
Molecular Formula C12H16O2
Exact Mass 192.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EENydUflQU4
Name Methyl (S)-3-Methyl-4-phenylbutanoate
Alternate Name(s) Methyl 3-Methyl-4-phenylbutanoate (S)-methyl 3-methyl-4-phenylbutanoate (3S)-3-methyl-4-phenylbutanoic acid methyl ester Methyl (3S)-3-methyl-4-phenylbutanoate Methyl (3S)-3-methyl-4-phenyl-butanoate
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Formula C12H16O2
InChI InChI=1S/C12H16O2/c1-10(9-12(13)14-2)8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3/t10-/m0/s1
InChIKey UIXSBHVUQGNCHV-JTQLQIEISA-N
Molecular Weight 192.258 g/mol
SMILES C(=O)(C[C@](Cc1ccccc1)(C)[H])OC
SPLASH splash10-014l-6900000000-fc420f22a8164ff95159
Source of Spectrum U1-2013-6930-8
Wiley ID 1738664