Product NameDimethyl malate
CAS38115-87-6
Molecular FormulaC6H10O5
Molecular Weight162.14
InChIInChI=1S/C6H10O5/c1-10-5(8)3-4(7)6(9)11-2/h4,7H,3H2,1-2H3
InChIKey YSEKNCXYRGKTBJ-UHFFFAOYSA-N
SmilesC(O)(C(=O)OC)CC(=O)OC
Mass
MS-NW-1212 dimethyl DL-malate C6H10O5 (Mass of molecular ion: 162)
Source Temperature: 250 °C Sample Temperature: 180 °C Reservoir, 75 eV
14.0 1.7 15.0 38.7 18.0 1.6 26.0 2.8 27.0 4.3 28.0 6.7 29.0 11.6 30.0 2.0 31.0 10.3 32.0 1.8 33.0 22.0 41.0 1.3 42.0 10.7 43.0 70.4 44.0 11.3 45.0 2.1 53.0 1.1 54.0 1.6 55.0 4.0 57.0 1.1 58.0 1.0 59.0 24.0 61.0 43.3 69.0 1.3 71.0 85.3 72.0 2.8 74.0 8.6 85.0 2.9 101.0 1.2 102.0 7.3 103.0 100.0 104.0 4.5 113.0 8.9 114.0 2.4 130.0 3.6 131.0 5.1
90 MHz in CDCl3
1H NMR | 89.56 MHz |
C6 H10 O5 | 0.04 ml : 0.5 ml CDCl3 |
dimethyl DL-malate |
Assign. Shift(ppm) |
Hz ppm Int.
411.06 4.590 48 405.88 4.532 58 405.31 4.526 69 400.38 4.471 56 341.63 3.815 928 339.50 3.791 54 338.50 3.780 37 333.19 3.721 1000 331.56 3.703 41 314.81 3.516 153 257.13 2.872 163 256.81 2.868 163 252.38 2.818 116 250.94 2.802 114
in CDCl3
CCl4 solution
liquid film
4880 A,200 M,liquid
Dimethyl malate(38115-87-6) MS Atlas of Related Products
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