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(R)-2-Hydroxy-4-(3,4-dimethylphenyl)-2-trifluoromethyl-pent-4-enoic acid ethyl ester
SpectraBase Compound ID HZ503XHb8Ww
InChI InChI=1S/C16H19F3O3/c1-5-22-14(20)15(21,16(17,18)19)9-12(4)13-7-6-10(2)11(3)8-13/h6-8,21H,4-5,9H2,1-3H3/t15-/m1/s1
InChIKey QKNMNUHVLOEHGP-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 1uYhfQ9AzQ
Name (R)-2-Hydroxy-4-(3,4-dimethylphenyl)-2-trifluoromethyl-pent-4-enoic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19F3O3
InChI InChI=1S/C16H19F3O3/c1-5-22-14(20)15(21,16(17,18)19)9-12(4)13-7-6-10(2)11(3)8-13/h6-8,21H,4-5,9H2,1-3H3/t15-/m1/s1
InChIKey QKNMNUHVLOEHGP-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(c1cc(c(cc1)C)C)=C
SPLASH splash10-017i-1932000000-778f92b6019e0e73786f
Source of Spectrum CAJ-7-1195/SM6-7g
Synonyms (R)-ethyl 4-(3,4-dimethylphenyl)-2-hydroxy-2-(trifluoromethyl)pent-4-enoate
Wiley ID 1773237