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4-Hydroxycarbonyl-2-oxobutyltriphenylphosphonium bromide
SpectraBase Compound ID 1z6Q9RuS7Dh
InChI InChI=1S/C23H21O3P.BrH/c24-19(16-17-23(25)26)18-27(20-10-4-1-5-11-20,21-12-6-2-7-13-21)22-14-8-3-9-15-22;/h1-15H,16-18H2;1H
InChIKey NCXXEWJNJHQWFP-UHFFFAOYSA-N
Mol Weight 457.3 g/mol
Molecular Formula C23H22BrO3P
Exact Mass 456.048995 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1drccLbcMcv
Name 4-Hydroxycarbonyl-2-oxobutyltriphenylphosphonium bromide
Alternate Name(s) (4-carboxy-2-oxobutyl)(triphenyl)phosphonium bromide
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Formula C23H22BrO3P
InChI InChI=1S/C23H21O3P.BrH/c24-19(16-17-23(25)26)18-27(20-10-4-1-5-11-20,21-12-6-2-7-13-21)22-14-8-3-9-15-22;/h1-15H,16-18H2;1H
InChIKey NCXXEWJNJHQWFP-UHFFFAOYSA-N
Molecular Weight 457.304 g/mol
SMILES [Br-].OC(CCC(C[P+](c1ccccc1)(c1ccccc1)c1ccccc1)=O)=O
SPLASH splash10-0nn9-9640000000-e5cadb339750e6373169
Source of Spectrum F-38-2393-0
Wiley ID 1389221