1,9-NONANEDIOL DIACETATE(4944-60-9) IR1
Product Name1,9-NONANEDIOL DIACETATE
CAS4944-60-9
Molecular FormulaC13H24O4
Molecular Weight244.33
InChIInChI=1S/C13H24O4/c1-12(14)16-10-8-6-4-3-5-7-9-11-17-13(2)15/h3-11H2,1-2H3
InChIKey JAEVCKMMGIFOCL-UHFFFAOYSA-N
SmilesC(OC(=O)C)CCCCCCCCOC(=O)C
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MassMS-IW-9042 nonamethylene diacetate C13H24O4 (Mass of molecular ion: 244)
Source Temperature: 200 °C Sample Temperature: 150 °C Reservoir, 75 eV
15.0 2.7 18.0 1.1 27.0 2.8 28.0 2.6 29.0 5.2 39.0 3.3 41.0 17.5 42.0 7.3 43.0 100.0 44.0 2.8 45.0 2.6 53.0 2.1 54.0 24.3 55.0 27.9 56.0 6.5 57.0 4.0 58.0 1.6 60.0 2.0 61.0 13.5 66.0 5.3 67.0 33.5 68.0 36.9 69.0 17.4 70.0 4.0 71.0 2.6 72.0 1.3 73.0 4.4 79.0 1.9 80.0 1.7 81.0 27.8 82.0 46.9 83.0 12.8 84.0 2.9 85.0 1.0 94.0 1.6 95.0 24.9 96.0 27.6 97.0 6.7 98.0 1.8 101.0 1.7 109.0 3.5 112.0 1.0 123.0 3.8 124.0 18.3 125.0 2.3 141.0 1.0 201.0 1.3
400 MHz in CDCl3
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1H NMR 399.65 MHz C13 H24 O4 0.05 ml : 0.5 ml CDCl3 nonamethylene diacetate 
Assign. Shift(ppm)
A 4.053 B 2.046 C 1.62 D 1.32
Hz ppm Int.1626.59 4.071 185 1619.87 4.054 355 1613.04 4.037 193 817.63 2.046 1000 654.66 1.639 64 647.58 1.621 97 640.50 1.603 79 633.67 1.586 29 543.95 1.362 48 526.25 1.317 256
in CDCl3
liquid film
