Acetoacetic acid 1-methylbutyl ester(6830-12-2) IR1

Product NameAcetoacetic acid 1-methylbutyl ester

CAS 6830-12-2

Molecular Formula

Molecular Weight

InChIInChI=1S/C9H16O3/c1-4-5-8(3)12-9(11)6-7(2)10/h8H,4-6H2,1-3H3

InChIKey WWEDSTVSBCEXAD-UHFFFAOYSA-N

SmilesO(C(C)CCC)C(=O)CC(=O)C

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¹³CNMR

IR1

       ppm   Int.  Assign.

      200.60   239      1
      167.02   328      2
       76.59   475      3
       50.43   525      4
       30.10   308      5
       26.40  1000      6
        9.55   857      7

Spectral Code: 13C NMR : in CDCl3

Spectral Code: IR : liquid film

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