Heptyltriphenylphosphonium bromide(13423-48-8) IR1
Product NameHeptyltriphenylphosphonium bromide
CAS13423-48-8
Molecular FormulaC25H30BrP
Molecular Weight441.38
InChIInChI=1S/C25H30P.BrH/c1-2-3-4-5-15-22-26(23-16-9-6-10-17-23,24-18-11-7-12-19-24)25-20-13-8-14-21-25;/h6-14,16-21H,2-5,15,22H2,1H3;1H/q+1;/p-1
InChIKey WCZSOHSGMBVYFW-UHFFFAOYSA-M
Smiles[P+](CCCCCCC)(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.[Br-]
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MassMS-NW-9075 heptyltriphenylphosphonium bromide C25H30BrP (Mass of molecular ion: 440)
Source Temperature: 270 °C Sample Temperature: 220 °C Direct, 75 eV
27.0 2.7 28.0 1.2 29.0 4.8 39.0 3.4 41.0 11.3 42.0 4.9 43.0 8.2 51.0 2.5 54.0 1.1 55.0 10.2 56.0 10.2 57.0 20.5 69.0 5.9 70.0 4.5 77.0 1.3 79.0 1.2 80.0 5.1 81.0 1.7 82.0 4.9 91.0 1.0 98.0 2.1 107.0 8.5 108.0 34.2 109.0 3.0 115.0 1.7 131.0 1.1 133.0 1.7 135.0 6.9 137.0 6.8 152.0 4.8 153.0 1.2 154.0 1.3 157.0 2.0 170.0 1.4 183.0 45.6 184.0 14.4 185.0 8.9 186.0 2.0 199.0 1.1 261.0 15.7 262.0 100.0 263.0 19.5 264.0 1.8 289.0 7.0 290.0 1.5 359.0 1.0 361.0 2.8
KBr disc
nujol mull
