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(3S)-Methyl .beta.-butyryloxy-.beta.-phenylpropionate
SpectraBase Compound ID EGTQKHoN4pY
InChI InChI=1S/C14H18O4/c1-3-7-13(15)18-12(10-14(16)17-2)11-8-5-4-6-9-11/h4-6,8-9,12H,3,7,10H2,1-2H3/t12-/m0/s1
InChIKey UCFVHIHSPXERAF-LBPRGKRZSA-N
Mol Weight 250.29 g/mol
Molecular Formula C14H18O4
Exact Mass 250.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9tVllfUkbkY
Name (3S)-Methyl .beta.-butyryloxy-.beta.-phenylpropionate
Alternate Name(s) (1S)-3-methoxy-3-oxo-1-phenylpropyl butyrate
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Formula C14H18O4
InChI InChI=1S/C14H18O4/c1-3-7-13(15)18-12(10-14(16)17-2)11-8-5-4-6-9-11/h4-6,8-9,12H,3,7,10H2,1-2H3/t12-/m0/s1
InChIKey UCFVHIHSPXERAF-LBPRGKRZSA-N
Molecular Weight 250.294 g/mol
SMILES C([C@](OC(=O)CCC)(c1ccccc1)[H])C(=O)OC
SPLASH splash10-05di-3900000000-1bc2a189593be7b7c414
Source of Spectrum KC-61-2175-5
Wiley ID 1627926