Iodonitrotetrazolium chloride(146-68-9) MS
Product NameIodonitrotetrazolium chloride
CAS146-68-9
Molecular FormulaC19H13ClIN5O2
Molecular Weight505.7
InChIInChI=1S/C19H13IN5O2.ClH/c20-15-6-8-16(9-7-15)23-21-19(14-4-2-1-3-5-14)22-24(23)17-10-12-18(13-11-17)25(26)27;/h1-13H;1H/q+1;/p-1
InChIKey JORABGDXCIBAFL-UHFFFAOYSA-M
Smiles[N+]1(=NC(C2C=CC=CC=2)=NN1C1C=CC(I)=CC=1)C1=CC=C([N+]([O-])=O)C=C1.[Cl-]
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MassMS-NW-0620 3-(p-iodophenyl)-2-(p-nitrophenyl)-5-phenyl-2H-tetrazolium chloride C19H13ClIN5O2 (Mass of molecular ion: 505)
Source Temperature: 240 °C Sample Temperature: 220 °C Direct, 75 eV
14.0 1.2 17.0 2.3 18.0 10.3 26.0 2.1 27.0 4.1 28.0 42.0 29.0 1.8 30.0 14.3 32.0 1.2 35.0 4.4 36.0 33.0 37.0 5.0 38.0 10.5 39.0 22.6 40.0 1.7 41.0 4.9 42.0 1.5 43.0 4.3 44.0 2.4 49.0 2.4 50.0 32.4 51.0 16.5 52.0 6.7 53.0 1.9 54.0 1.4 55.0 4.6 56.0 1.9 57.0 4.4 60.0 1.2 61.0 3.3 62.0 8.4 63.0 43.0 64.0 17.9 65.0 8.8 66.0 1.7 67.0 2.2 68.0 1.4 69.0 3.4 69.5 1.3 70.0 1.7 71.0 2.4 73.0 3.6 74.0 13.0 75.0 19.9 76.0 50.8 77.0 26.9 78.0 3.8 79.0 2.4 80.0 3.1 81.0 2.3 82.0 1.9 82.5 1.8 83.0 2.9 84.0 1.8 85.0 1.5 86.0 1.6 87.0 2.6 88.0 2.7 89.0 6.5 90.0 80.1 91.0 10.3 92.0 6.8 93.0 3.5 95.0 1.5 96.0 1.3 96.5 1.2 97.0 2.1 98.0 1.8 99.0 3.9 100.0 1.2 101.0 1.6 102.0 1.6 103.0 31.5 104.0 6.9 105.0 22.4 106.0 6.3 107.0 1.7 108.0 2.0 109.0 1.5 110.0 1.0 111.0 11.0 112.0 1.6 113.0 3.9 114.0 1.7 115.0 2.2 116.0 1.6 117.0 1.3 120.0 1.0 121.0 2.1 122.0 1.3 123.0 1.4 125.0 12.1 126.0 2.4 127.0 8.4 128.0 4.6 129.0 1.6 136.0 5.0 137.0 1.5 138.0 3.5 139.0 7.8 140.0 4.7 141.0 1.4 145.0 3.5 150.0 2.5 151.0 5.0 152.0 3.6 153.0 1.6 154.0 1.0 157.0 5.4 159.0 1.9 160.0 1.8 163.0 5.4 164.0 6.9 165.0 21.3 166.0 17.1 167.0 5.6 168.0 1.7 177.0 1.6 178.0 2.2 179.0 1.6 180.0 1.2 181.0 2.0 182.0 1.2 186.0 1.4 191.0 3.7 192.0 7.6 193.0 11.8 194.0 5.9 195.0 1.4 200.0 1.1 203.0 22.0 204.0 3.9 209.0 4.7 210.0 1.3 211.0 1.6 217.0 77.7 218.0 7.8 219.0 11.6 220.0 5.3 223.0 1.2 224.0 2.3 225.0 1.2 226.0 1.2 227.0 1.0 228.0 8.6 229.0 1.8 230.0 3.2 231.0 1.3 233.0 1.2 238.0 4.2 239.0 28.2 240.0 5.9 241.0 1.5 249.0 25.3 250.0 1.9 254.0 1.2 267.0 1.1 268.0 1.4 275.0 4.8 277.0 1.6 278.0 1.8 292.0 4.8 293.0 1.6 305.0 2.3 306.0 1.8 308.0 1.8 310.0 1.4 319.0 1.1 320.0 100.0 321.0 15.6 322.0 1.8 325.0 1.1 330.0 36.0 331.0 2.6 340.0 2.3 341.0 1.0 342.0 3.0 356.0 3.5 358.0 1.4 359.0 1.6 396.0 1.2 411.0 2.6 423.0 1.4 426.0 1.0 440.0 1.0 441.0 5.6 442.0 1.4 451.0 2.3 522.0 1.7 532.0 1.2
KBr disc
nujol mull
