2-(6-ETHOXYCARBONYLHEXYL)CYCLOPENTANONE(40687-10-3) 13C NMR
Product Name2-(6-ETHOXYCARBONYLHEXYL)CYCLOPENTANONE
CAS40687-10-3
Molecular FormulaC14H24O3
Molecular Weight240.34
InChIInChI=1S/C14H24O3/c1-2-17-14(16)11-6-4-3-5-8-12-9-7-10-13(12)15/h12H,2-11H2,1H3
InChIKey FNXKYPCEPBQWRZ-UHFFFAOYSA-N
SmilesC1(CCCCCCC(OCC)=O)CCCC1=O
-
MassMS-IW-3477 ethyl 7-(2-oxocyclopentyl)heptanoate C14H24O3 (Mass of molecular ion: 240)
Source Temperature: 210 °C Sample Temperature: 160 °C Reservoir, 75 eV
27.0 5.4 28.0 2.6 29.0 11.7 39.0 5.0 40.0 1.3 41.0 22.0 42.0 4.9 43.0 5.5 45.0 2.4 53.0 3.1 54.0 4.4 55.0 27.6 56.0 3.9 57.0 2.3 60.0 4.6 61.0 3.0 67.0 8.5 68.0 3.5 69.0 15.1 70.0 4.0 71.0 2.0 73.0 4.5 79.0 3.1 80.0 1.7 81.0 6.8 82.0 2.2 83.0 28.7 84.0 100.0 85.0 7.7 87.0 1.5 88.0 5.1 93.0 3.2 94.0 1.4 95.0 3.9 96.0 3.0 97.0 14.1 98.0 6.9 99.0 1.0 101.0 4.1 107.0 1.7 109.0 2.6 110.0 5.1 111.0 26.4 112.0 3.0 115.0 1.3 123.0 4.9 124.0 1.5 125.0 1.0 129.0 2.6 135.0 2.1 137.0 1.5 138.0 2.0 148.0 1.4 149.0 3.1 151.0 1.1 152.0 1.3 156.0 4.1 157.0 25.8 158.0 2.7 159.0 1.3 166.0 4.1 194.0 6.6 195.0 15.2 196.0 2.0 240.0 3.4
in CDCl3
liquid film
