Diethyl isopropylmalonate(759-36-4) 13C NMR
Product NameDiethyl isopropylmalonate
CAS759-36-4
Molecular FormulaC10H18O4
Molecular Weight202.25
InChIInChI=1S/C10H18O4/c1-5-13-9(11)8(7(3)4)10(12)14-6-2/h7-8H,5-6H2,1-4H3
InChIKey BYQFBFWERHXONI-UHFFFAOYSA-N
SmilesC(OCC)(=O)C(C(C)C)C(OCC)=O
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Assign. Shift(ppm)
A 4.190 B 3.104 C 2.41 D 1.269 E 1.008Spectral Code: 1H NMR : 90 MHz in CDCl3
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ppm Int. Assign.
168.84 473 1 61.09 1000 2 59.17 533 3 28.80 467 4 20.41 725 5 14.18 802 6Spectral Code: 13C NMR : in CDCl3
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Spectral Code: IR : liquid film
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Spectral Code: Raman : 4880 A,200 M,liquid
