Cyclohexanone oxime(100-64-1) MS
Product NameCyclohexanone oxime
CAS100-64-1
Molecular FormulaC6H11NO
Molecular Weight113.16
InChIInChI=1S/C6H11NO/c8-7-6-4-2-1-3-5-6/h8H,1-5H2
InChIKey VEZUQRBDRNJBJY-UHFFFAOYSA-N
SmilesC1(=N/O)/CCCCC/1
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MassMS-NW-1838 cyclohexanone oxime C6H11NO (Mass of molecular ion: 113)
Source Temperature: 240 °C Sample Temperature: 180 °C Reservoir, 75 eV
15.0 4.4 18.0 3.6 26.0 7.5 27.0 46.8 28.0 24.7 29.0 26.6 30.0 9.5 31.0 3.7 37.0 2.1 38.0 5.5 39.0 52.2 40.0 14.4 41.0 100.0 42.0 42.7 43.0 7.4 44.0 9.1 45.0 2.2 46.0 14.7 50.0 3.9 51.0 7.2 52.0 6.4 53.0 20.5 54.0 49.5 55.0 69.1 56.0 7.8 57.0 7.1 58.0 1.7 59.0 57.0 60.0 1.7 63.0 1.2 64.0 1.2 65.0 4.0 66.0 5.5 67.0 37.8 68.0 37.2 69.0 22.8 70.0 6.0 71.0 1.8 72.0 45.2 73.0 2.1 77.0 2.8 79.0 10.6 80.0 6.8 81.0 27.3 82.0 5.6 83.0 2.5 84.0 14.7 85.0 22.2 86.0 1.5 94.0 3.9 95.0 1.2 96.0 19.7 97.0 4.5 98.0 22.3 99.0 1.4 112.0 3.6 113.0 70.3 114.0 5.4
90 MHz in CDCl3
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1H NMR 89.56 MHz C6 H11 N O 0.044 g : 0.5 ml CDCl3 cyclohexanone oxime 
Assign. Shift(ppm)
A 8.9 B 2.50 C 2.22 D 1.74 to 1.55
Hz ppm Int.798.00 8.911 50 230.94 2.579 104 228.19 2.548 148 225.00 2.513 283 220.50 2.463 159 219.25 2.449 196 205.06 2.290 107 199.56 2.229 261 199.06 2.223 257 195.69 2.186 149 193.31 2.159 219 189.88 2.121 42 160.81 1.796 42 160.38 1.791 41 158.13 1.766 61 156.00 1.742 116 151.69 1.694 250 145.75 1.628 1000 143.75 1.606 923 142.19 1.588 512
in CDCl3
KBr disc
nujol mull
4880 A,200 M,powder
