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2-[(4-Fluorophenyl)amino]-3-[ethoxycarbonyl-[(triphenylphosphoranyl)imino]methenyl]indole
SpectraBase Compound ID 5C5lhIJHwbs
InChI InChI=1S/C36H29FN3O2P/c1-2-42-36(41)34(33-31-20-12-13-21-32(31)39-35(33)38-27-24-22-26(37)23-25-27)40-43(28-14-6-3-7-15-28,29-16-8-4-9-17-29)30-18-10-5-11-19-30/h3-25H,2H2,1H3,(H,38,39)
InChIKey RWDITNSFAQRFNB-UHFFFAOYSA-N
Mol Weight 585.6 g/mol
Molecular Formula C36H29FN3O2P
Exact Mass 585.198142 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LBSotWaX30v
Name 2-[(4-Fluorophenyl)amino]-3-[ethoxycarbonyl-[(triphenylphosphoranyl)imino]methenyl]indole
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Formula C36H29FN3O2P
InChI InChI=1S/C36H29FN3O2P/c1-2-42-36(41)34(33-31-20-12-13-21-32(31)39-35(33)38-27-24-22-26(37)23-25-27)40-43(28-14-6-3-7-15-28,29-16-8-4-9-17-29)30-18-10-5-11-19-30/h3-25H,2H2,1H3,(H,38,39)
InChIKey RWDITNSFAQRFNB-UHFFFAOYSA-N
Molecular Weight 585.619 g/mol
SMILES N(C=1C(=C(N=P(c2ccccc2)(c2ccccc2)c2ccccc2)C(=O)OCC)c2c(cccc2)N1)c1ccc(cc1)F
SPLASH splash10-06si-0930000000-2f614509676e642965b8
Source of Spectrum F-48-3105-13d
Synonyms 2-[(4-Fluorophenyl)amino]-3-[ethoxycarbonyl-[(triphenylphosphoranyl)imino]methenyl]indole
Wiley ID 1408895