2,2,4,6,6-Pentamethyl-3-heptene(123-48-8) IR1

Product Name2,2,4,6,6-Pentamethyl-3-heptene

CAS 123-48-8

Molecular FormulaC12H24

Molecular Weight168.32

InChIInChI=1S/C12H24/c1-10(8-11(2,3)4)9-12(5,6)7/h8H,9H2,1-7H3

InChIKey NBUMCEJRJRRLCA-UHFFFAOYSA-N

SmilesCC(C)(C)C=C(C)CC(C)(C)C

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¹HNMR

IR1

Raman

2,2,4,6,6-Pentamethyl-3-heptene(123-48-8) IR1

    Assign.     Shift(ppm)

      A             5.11
      B             1.83
      C             1.76
      D             1.102
      E             0.881

Spectral Code: 1H NMR : 90 MHz in CDCl3

Spectral Code: IR : liquid film

Spectral Code: Raman : 4880 A,200 M,liquid

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