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N-(1-(Diphenylphosphoryl)-3-(4-methylbenzyl)-1H-inden-2-yl)benzamide
SpectraBase Compound ID bTkdCUMxov
InChI InChI=1S/C36H30NO2P/c1-26-21-23-27(24-22-26)25-33-31-19-11-12-20-32(31)35(34(33)37-36(38)28-13-5-2-6-14-28)40(39,29-15-7-3-8-16-29)30-17-9-4-10-18-30/h2-24,35H,25H2,1H3,(H,37,38)
InChIKey VQZJPLGLRNCKSA-UHFFFAOYSA-N
Mol Weight 539.6 g/mol
Molecular Formula C36H30NO2P
Exact Mass 539.201416 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 19fzZuKbsAa
Name N-(1-(Diphenylphosphoryl)-3-(4-methylbenzyl)-1H-inden-2-yl)benzamide
Appearance White solid
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Formula C36H30NO2P
InChI InChI=1S/C36H30NO2P/c1-26-21-23-27(24-22-26)25-33-31-19-11-12-20-32(31)35(34(33)37-36(38)28-13-5-2-6-14-28)40(39,29-15-7-3-8-16-29)30-17-9-4-10-18-30/h2-24,35H,25H2,1H3,(H,37,38)
InChIKey VQZJPLGLRNCKSA-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1021/acs.joc.1c00609
Molecular Weight 539.615 g/mol
Reported Formula C36H30NO2P
SMILES N(C=1C(c2c(C1Cc1ccc(cc1)C)cccc2)P(c1ccccc1)(=O)c1ccccc1)C(c1ccccc1)=O
SPLASH splash10-000i-0329030000-5f8c4152867068f4bdb2
Source of Spectrum JOC-86-9373-4c'
Wiley ID 1867875