Product NameMalic acid
CAS6915-15-7
Molecular FormulaC4H6O5
Molecular Weight134.09
InChIInChI=1S/C4H6O5/c5-2(4(8)9)1-3(6)7/h2,5H,1H2,(H,6,7)(H,8,9)
InChIKey BJEPYKJPYRNKOW-UHFFFAOYSA-N
SmilesC(O)(=O)C(O)CC(O)=O
Mass
MS-NW-3754 DL-malic acid C4H6O5 (Mass of molecular ion: 134)
Source Temperature: 220 °C Sample Temperature: 120 °C Direct, 75 eV
14.0 3.8 15.0 14.5 17.0 1.3 18.0 5.8 19.0 21.9 26.0 5.2 27.0 20.7 28.0 6.0 29.0 21.4 30.0 1.4 31.0 2.8 41.0 2.1 42.0 24.0 43.0 97.3 44.0 22.9 45.0 26.5 46.0 2.8 47.0 14.3 53.0 1.6 55.0 8.9 60.0 15.7 69.0 2.0 71.0 100.0 72.0 25.4 73.0 2.4 88.0 6.1 89.0 84.5 90.0 7.6 99.0 1.6
90 MHz in CDCl3
1H NMR | 89.56 MHz |
C4 H6 O5 | 0.05 g : 0.5 ml D2O |
DL-malic acid |
Assign. Shift(ppm) |
Hz ppm Int.
419.38 4.683 293 414.19 4.625 370 413.19 4.614 444 408.00 4.556 331 262.75 2.934 1000 257.69 2.878 628 256.31 2.862 587
in D2O
KBr disc
nujol mull
Malic acid (6915-15-7) Raman Atlas of Related Products
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