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Methyl N-(4-iodo-N-phenylsulponylindolyl-3-methylene)phenylalaninate
SpectraBase Compound ID ElDpvhinUwW
InChI InChI=1S/C25H21IN2O4S/c1-32-25(29)22(15-18-9-4-2-5-10-18)27-16-19-17-28(23-14-8-13-21(26)24(19)23)33(30,31)20-11-6-3-7-12-20/h2-14,16-17,22H,15H2,1H3/b27-16+
InChIKey OWLHWSCRDUDWGP-JVWAILMASA-N
Mol Weight 572.42 g/mol
Molecular Formula C25H21IN2O4S
Exact Mass 572.026673 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 58zH5eV0FRo
Name Methyl N-(4-iodo-N-phenylsulponylindolyl-3-methylene)phenylalaninate
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Formula C25H21IN2O4S
InChI InChI=1S/C25H21IN2O4S/c1-32-25(29)22(15-18-9-4-2-5-10-18)27-16-19-17-28(23-14-8-13-21(26)24(19)23)33(30,31)20-11-6-3-7-12-20/h2-14,16-17,22H,15H2,1H3/b27-16+
InChIKey OWLHWSCRDUDWGP-JVWAILMASA-N
Molecular Weight 572.417 g/mol
SMILES c1(S([n]2cc(\C=N\C(C(=O)OC)Cc3ccccc3)c3c2cccc3I)(=O)=O)ccccc1
SPLASH splash10-0036-9011400000-1bba312ee78b1a2ee17d
Source of Spectrum F-51-301-10e
Wiley ID 790380