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N-(1-Benzyl-3-(diphenylphosphoryl)-6-methoxy-1H-inden-2-yl)-benzamide
SpectraBase Compound ID 6Cs7FtuhGAX
InChI InChI=1S/C36H30NO3P/c1-40-28-22-23-31-32(25-28)33(24-26-14-6-2-7-15-26)34(37-36(38)27-16-8-3-9-17-27)35(31)41(39,29-18-10-4-11-19-29)30-20-12-5-13-21-30/h2-23,25,33H,24H2,1H3,(H,37,38)
InChIKey CWWPIXKDAQMEIZ-UHFFFAOYSA-N
Mol Weight 555.6 g/mol
Molecular Formula C36H30NO3P
Exact Mass 555.196331 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EDE2zQrKqmD
Name N-(1-Benzyl-3-(diphenylphosphoryl)-6-methoxy-1H-inden-2-yl)-benzamide
Appearance Brown sticky-gum
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Formula C36H30NO3P
InChI InChI=1S/C36H30NO3P/c1-40-28-22-23-31-32(25-28)33(24-26-14-6-2-7-15-26)34(37-36(38)27-16-8-3-9-17-27)35(31)41(39,29-18-10-4-11-19-29)30-20-12-5-13-21-30/h2-23,25,33H,24H2,1H3,(H,37,38)
InChIKey CWWPIXKDAQMEIZ-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1021/acs.joc.1c00609
Molecular Weight 555.614 g/mol
Reported Formula C36H30NO3P
SMILES N(C1=C(c2c(C1Cc1ccccc1)cc(cc2)OC)P(c1ccccc1)(=O)c1ccccc1)C(c1ccccc1)=O
SPLASH splash10-0zfr-0409020000-b823a1999baaea6a42e9
Source of Spectrum JOC-86-9376-4m
Wiley ID 1867889