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(Z/E)-N-[3-(Anthracen-9-yl)-2-fluoro-2-propenyl]-phenylalanine ethyl ester
SpectraBase Compound ID 1TvM6F3Ug78
InChI InChI=1S/C28H26FNO2/c1-2-32-28(31)27(16-20-10-4-3-5-11-20)30-19-23(29)18-26-24-14-8-6-12-21(24)17-22-13-7-9-15-25(22)26/h3-15,17-18,27,30H,2,16,19H2,1H3/b23-18-
InChIKey DKCJETONBYQFAL-NKFKGCMQSA-N
Mol Weight 427.52 g/mol
Molecular Formula C28H26FNO2
Exact Mass 427.194757 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3kABgiDid6
Name (Z/E)-N-[3-(Anthracen-9-yl)-2-fluoro-2-propenyl]-phenylalanine ethyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C28H26FNO2
InChI InChI=1S/C28H26FNO2/c1-2-32-28(31)27(16-20-10-4-3-5-11-20)30-19-23(29)18-26-24-14-8-6-12-21(24)17-22-13-7-9-15-25(22)26/h3-15,17-18,27,30H,2,16,19H2,1H3/b23-18-
InChIKey DKCJETONBYQFAL-NKFKGCMQSA-N
Molecular Weight 427.519 g/mol
SMILES N(C(C(=O)OCC)Cc1ccccc1)C\C(=C\c1c2c(cccc2)cc2c1cccc2)F
SPLASH splash10-004r-0080900000-8996e83430bd93c05bf1
Source of Spectrum F-67-1403-4d
Wiley ID 1685775