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[.alpha.-Benzotriazol-1-yl-.alpha.(4-methylbenzoyl)methylene]triphenylphosphorane
SpectraBase Compound ID Jzszd0TLk6y
InChI InChI=1S/C33H26N3OP/c1-25-21-23-26(24-22-25)32(37)33(36-31-20-12-11-19-30(31)34-35-36)38(27-13-5-2-6-14-27,28-15-7-3-8-16-28)29-17-9-4-10-18-29/h2-24H,1H3
InChIKey LHIIQVALCVNJRR-UHFFFAOYSA-N
Mol Weight 511.6 g/mol
Molecular Formula C33H26N3OP
Exact Mass 511.181349 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F3jhG0J9cpC
Name [.alpha.-Benzotriazol-1-yl-.alpha.(4-methylbenzoyl)methylene]triphenylphosphorane
Alternate Name(s) 2-(1H-1,2,3-benzotriazol-1-yl)-1-(4-methylphenyl)-2-(triphenylphosphoranylidene)ethanone alpha.-Benzotriazol-1-yl-.alpha.(4-methylbenzoyl)methylene]triphenylphosphorane 2-(1-benzotriazolyl)-1-(4-methylphenyl)-2-triphenylphosphoranylideneethanone 2-(benzotriazol-1-yl)-1-(p-tolyl)-2-(triphenyl-$l^{5}-phosphanylidene)ethanone 2-(benzotriazol-1-yl)-1-(4-methylphenyl)-2-(triphenyl-$l^{5}-phosphanylidene)ethanone
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Formula C33H26N3OP
InChI InChI=1S/C33H26N3OP/c1-25-21-23-26(24-22-25)32(37)33(36-31-20-12-11-19-30(31)34-35-36)38(27-13-5-2-6-14-27,28-15-7-3-8-16-28)29-17-9-4-10-18-29/h2-24H,1H3
InChIKey LHIIQVALCVNJRR-UHFFFAOYSA-N
Molecular Weight 511.565 g/mol
SMILES C([n]1nnc2c1cccc2)(=P(c1ccccc1)(c1ccccc1)c1ccccc1)C(c1ccc(cc1)C)=O
SPLASH splash10-07wc-2911000000-28bab4397681ded9d85e
Source of Spectrum KC-0-3110-2
Wiley ID 823688