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(3-Carboxypropyl)triphenylphosphonium bromide
SpectraBase Compound ID 9gwABZio2Z8
InChI InChI=1S/C22H21O2P.BrH/c23-22(24)17-10-18-25(19-11-4-1-5-12-19,20-13-6-2-7-14-20)21-15-8-3-9-16-21;/h1-9,11-16H,10,17-18H2;1H
InChIKey NKVJKVMGJABKHV-UHFFFAOYSA-N
Mol Weight 429.29 g/mol
Molecular Formula C22H22BrO2P
Exact Mass 428.05408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IHExh5NRCC3
Name (3-carboxypropyl)(triphenyl)phosphonium bromide
Alternate Name(s) 3-carboxypropyl(triphenyl)phosphanium;bromide (4-oxidanyl-4-oxidanylidene-butyl)-triphenyl-phosphanium;bromide
Comments Less than 3 mono-isotopic peaks
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Formula C22H22BrO2P
InChI InChI=1S/C22H21O2P.BrH/c23-22(24)17-10-18-25(19-11-4-1-5-12-19,20-13-6-2-7-14-20)21-15-8-3-9-16-21;/h1-9,11-16H,10,17-18H2;1H
InChIKey NKVJKVMGJABKHV-UHFFFAOYSA-N
Molecular Weight 429.294 g/mol
SMILES [Br-].OC(CCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1)=O
SPLASH splash10-03di-0090000000-69bbc42a4fd8aa193c64
Source of Spectrum K-110-3550-0
Wiley ID 1380635