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(Z)-N-[3-(4-Bromophenyl)-2-fluoro-2-propenyl]-phenylalanine ethyl ester
SpectraBase Compound ID IuNoOyYb9J4
InChI InChI=1S/C20H21BrFNO2/c1-2-25-20(24)19(13-15-6-4-3-5-7-15)23-14-18(22)12-16-8-10-17(21)11-9-16/h3-12,19,23H,2,13-14H2,1H3/b18-12-
InChIKey UBEDTKWBAITXAK-PDGQHHTCSA-N
Mol Weight 406.3 g/mol
Molecular Formula C20H21BrFNO2
Exact Mass 405.07397 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1NHGPi2eAVg
Name (Z)-N-[3-(4-Bromophenyl)-2-fluoro-2-propenyl]-phenylalanine ethyl ester
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Formula C20H21BrFNO2
InChI InChI=1S/C20H21BrFNO2/c1-2-25-20(24)19(13-15-6-4-3-5-7-15)23-14-18(22)12-16-8-10-17(21)11-9-16/h3-12,19,23H,2,13-14H2,1H3/b18-12-
InChIKey UBEDTKWBAITXAK-PDGQHHTCSA-N
Molecular Weight 406.295 g/mol
SMILES N(C(C(=O)OCC)Cc1ccccc1)C\C(=C\c1ccc(Br)cc1)F
SPLASH splash10-08fr-0090700000-0a6510c371f8fa536634
Source of Spectrum F-67-1403-5d
Wiley ID 1685774