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2-Benzyl-3,3-dimethyl-2-[(2,2,2-trifluoroacetyl)amino]pent-4-enoic acid methyl ester
SpectraBase Compound ID A9O7wFneq6o
InChI InChI=1S/C17H20F3NO3/c1-5-15(2,3)16(14(23)24-4,21-13(22)17(18,19)20)11-12-9-7-6-8-10-12/h5-10H,1,11H2,2-4H3,(H,21,22)
InChIKey BWPUWIYLBJLPOB-UHFFFAOYSA-N
Mol Weight 343.35 g/mol
Molecular Formula C17H20F3NO3
Exact Mass 343.139528 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5xG5dFjICM
Name 2-Benzyl-3,3-dimethyl-2-[(2,2,2-trifluoroacetyl)amino]pent-4-enoic acid methyl ester
Alternate Name(s) 3,3-Dimethyl-2-(phenylmethyl)-2-[(2,2,2-trifluoro-1-oxoethyl)amino]-4-pentenoic acid methyl ester Methyl 2-benzyl-3,3-dimethyl-2-[(2,2,2-trifluoroacetyl)amino]pent-4-enoate Methyl 3,3-dimethyl-2-(phenylmethyl)-2-[2,2,2-tris(fluoranyl)ethanoylamino]pent-4-enoate
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Formula C17H20F3NO3
InChI InChI=1S/C17H20F3NO3/c1-5-15(2,3)16(14(23)24-4,21-13(22)17(18,19)20)11-12-9-7-6-8-10-12/h5-10H,1,11H2,2-4H3,(H,21,22)
InChIKey BWPUWIYLBJLPOB-UHFFFAOYSA-N
Molecular Weight 343.346 g/mol
SMILES N(C(C(=O)OC)(C(C=C)(C)C)Cc1ccccc1)C(C(F)(F)F)=O
SPLASH splash10-03l0-0190000000-f4f89613846c49aae35d
Source of Spectrum J-61-3699-5
Wiley ID 1337214