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Methyl (S)-7-(4-Fluorophenyl)-7-hydroxyheptanoate
SpectraBase Compound ID DY34nVNduWH
InChI InChI=1S/C14H19FO3/c1-18-14(17)6-4-2-3-5-13(16)11-7-9-12(15)10-8-11/h7-10,13,16H,2-6H2,1H3/t13-/m0/s1
InChIKey XQCICSMAHRCOEC-ZDUSSCGKSA-N
Mol Weight 254.3 g/mol
Molecular Formula C14H19FO3
Exact Mass 254.131823 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 59cwg41tNQ
Name Methyl (S)-7-(4-Fluorophenyl)-7-hydroxyheptanoate
Alternate Name(s) (7S)-7-(4-fluorophenyl)-7-hydroxy-enanthic acid methyl ester (7S)-7-(4-fluorophenyl)-7-hydroxyheptanoic acid methyl ester Methyl (7S)-7-(4-fluorophenyl)-7-hydroxy-heptanoate Methyl (7S)-7-(4-fluorophenyl)-7-oxidanyl-heptanoate
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Formula C14H19FO3
InChI InChI=1S/C14H19FO3/c1-18-14(17)6-4-2-3-5-13(16)11-7-9-12(15)10-8-11/h7-10,13,16H,2-6H2,1H3/t13-/m0/s1
InChIKey XQCICSMAHRCOEC-ZDUSSCGKSA-N
Molecular Weight 254.301 g/mol
SMILES O[C@@](CCCCCC(=O)OC)(c1ccc(cc1)F)[H]
SPLASH splash10-005i-4900000000-eb43e4796c348cc7ee77
Source of Spectrum E1-44-754-7
Wiley ID 1553366