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2-[(Triphenylphosphoranylidene)amino]-1,6-methano[10]annulene
SpectraBase Compound ID HL8qwWkqAEa
InChI InChI=1S/C29H24NP/c1-4-16-26(17-5-1)31(27-18-6-2-7-19-27,28-20-8-3-9-21-28)30-29-22-12-14-24-13-10-11-15-25(29)23-24/h1-22H,23H2
InChIKey DEANECIYKJFCNZ-UHFFFAOYSA-N
Mol Weight 417.49 g/mol
Molecular Formula C29H24NP
Exact Mass 417.164637 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B5oz0cHqQD1
Name 2-[(Triphenylphosphoranylidene)amino]-1,6-methano[10]annulene
Alternate Name(s) N-bicyclo[4.4.1]undeca-1(10),2,4,6,8-pentaen-2-yl(triphenyl)phosphine imide [bicyclo[4.4.1]undeca-1(10),2,4,6,8-pentaen-2-ylimino](triphenyl)phosphorane
CAS Registry Number 134858-17-6
Comments Less than 3 mono-isotopic peaks
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Formula C29H24NP
InChI InChI=1S/C29H24NP/c1-4-16-26(17-5-1)31(27-18-6-2-7-19-27,28-20-8-3-9-21-28)30-29-22-12-14-24-13-10-11-15-25(29)23-24/h1-22H,23H2
InChIKey DEANECIYKJFCNZ-UHFFFAOYSA-N
Molecular Weight 417.492 g/mol
SMILES C=1(N=P(c2ccccc2)(c2ccccc2)c2ccccc2)C=2CC(=CC=CC2)C=CC1
SPLASH splash10-0159-0800900000-479d0bf632cf6175de2f
Source of Spectrum J-57-623-8
Wiley ID 1376935