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(R)-2-Hydroxy-4-(4-ethylphenyl)-2-trifluoromethyl-pent-4-enoic acid ethyl ester
SpectraBase Compound ID 2Yjvh17Cwr2
InChI InChI=1S/C16H19F3O3/c1-4-12-6-8-13(9-7-12)11(3)10-15(21,16(17,18)19)14(20)22-5-2/h6-9,21H,3-5,10H2,1-2H3/t15-/m1/s1
InChIKey XXXLPFWEUCIGOF-OAHLLOKOSA-N
Mol Weight 316.32 g/mol
Molecular Formula C16H19F3O3
Exact Mass 316.128629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BYTelaL8Uby
Name (R)-2-Hydroxy-4-(4-ethylphenyl)-2-trifluoromethyl-pent-4-enoic acid ethyl ester
Alternate Name(s) (R)-ethyl 4-(4-ethylphenyl)-2-hydroxy-2-(trifluoromethyl)pent-4-enoate
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Formula C16H19F3O3
InChI InChI=1S/C16H19F3O3/c1-4-12-6-8-13(9-7-12)11(3)10-15(21,16(17,18)19)14(20)22-5-2/h6-9,21H,3-5,10H2,1-2H3/t15-/m1/s1
InChIKey XXXLPFWEUCIGOF-OAHLLOKOSA-N
Literature Reference DOI 10.1002/asia.201200063
Molecular Weight 316.320 g/mol
SMILES O[C@](C(OCC)=O)(C(F)(F)F)CC(c1ccc(CC)cc1)=C
SPLASH splash10-014i-2900000000-03e2e797335803e90281
Source of Spectrum CAJ-7-1195/SM4-7d
Wiley ID 1773234