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Ethyl (Z)- and (E)-2,4,4,4-tetrafluoro-3-(1H-indol-3-yl)but-2-enoate
SpectraBase Compound ID IqToxO9vjtn
InChI InChI=1S/C14H11F4NO2/c1-2-21-13(20)12(15)11(14(16,17)18)9-7-19-10-6-4-3-5-8(9)10/h3-7,19H,2H2,1H3/b12-11-
InChIKey SONBIKBCJWSRCW-QXMHVHEDSA-N
Mol Weight 301.24 g/mol
Molecular Formula C14H11F4NO2
Exact Mass 301.072591 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EXfRBvHQ7dK
Name Ethyl (Z)- and (E)-2,4,4,4-tetrafluoro-3-(1H-indol-3-yl)but-2-enoate
Alternate Name(s) (Z)-ethyl 2,4,4,4-tetrafluoro-3-(1H-indol-3-yl)but-2-enoate
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Formula C14H11F4NO2
InChI InChI=1S/C14H11F4NO2/c1-2-21-13(20)12(15)11(14(16,17)18)9-7-19-10-6-4-3-5-8(9)10/h3-7,19H,2H2,1H3/b12-11-
InChIKey SONBIKBCJWSRCW-QXMHVHEDSA-N
Literature Reference DOI 10.2174/1570178611666140124001052
Molecular Weight 301.241 g/mol
SMILES [nH]1cc(c2c1cccc2)\C(=C/(F)C(OCC)=O)C(F)(F)F
SPLASH splash10-0udi-0394000000-8838c4da15d2bdb81d74
Source of Spectrum LOC-11-378-4e
Wiley ID 1747408