5-Chloro-1-methyl-4-nitroimidazole(4897-25-0) IR1
Product Name5-Chloro-1-methyl-4-nitroimidazole
CAS4897-25-0
Molecular FormulaC4H4ClN3O2
Molecular Weight161.55
InChIInChI=1S/C4H4ClN3O2/c1-7-2-6-4(3(7)5)8(9)10/h2H,1H3
InChIKey OSJUNMSWBBOTQU-UHFFFAOYSA-N
SmilesC1N(C)C(Cl)=C([N+]([O-])=O)N=1
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MassMS2004-02538WA 5-chloro-1-methyl-4-nitroimidazole C4H4ClN3O2 (Mass of molecular ion: 161)
Source Temperature: 120 °C Sample Temperature: 100 °C Direct, 70 eV
14.0 1.0 15.0 17.8 17.0 1.3 18.0 6.6 26.0 2.8 27.0 4.3 28.0 10.2 29.0 1.6 30.0 16.1 36.0 1.3 38.0 4.7 39.0 4.4 40.0 4.6 41.0 5.0 42.0 34.0 43.0 1.5 44.0 1.4 46.0 1.5 47.0 4.6 48.0 1.2 49.0 10.4 50.0 1.0 51.0 9.0 52.0 8.7 53.0 7.8 59.0 1.0 61.0 4.6 62.0 2.1 63.0 2.4 64.0 1.0 65.0 2.0 66.0 1.1 67.0 4.2 73.0 4.8 74.0 14.3 75.0 5.8 76.0 83.0 77.0 4.2 78.0 26.0 79.0 3.8 80.0 19.7 81.0 1.2 83.0 13.4 86.0 4.4 87.0 1.2 88.0 5.6 89.0 1.1 90.0 1.7 100.0 2.5 102.0 1.0 104.0 17.6 106.0 5.6 110.0 4.2 115.0 17.4 117.0 5.6 131.0 3.8 133.0 1.3 145.0 4.2 147.0 1.4 161.0 100.0 162.0 5.8 163.0 33.0 164.0 1.9
KBr disk
Nujol
