Product Name9-Hexylanthracene

CAS

Molecular FormulaC20H22

Molecular Weight262.38868

InChIInChI=1S/C20H22/c1-2-3-4-5-14-20-18-12-8-6-10-16(18)15-17-11-7-9-13-19(17)20/h6-13,15H,2-5,14H2,1H3

InChIKey FFQDRQHAHQLKBE-UHFFFAOYSA-N

SmilesC1C2C(=CC3=C(C=2CCCCCC)C=CC=C3)C=CC=1

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¹HNMR

¹³CNMR

IR1

    Assign.     Shift(ppm)

      A             8.299
      B             8.251
      C             7.977
      D             7.481
      E             7.435
      F             3.576
      G             1.795
      J             1.575
      K             1.39
      L             1.35
      M             0.910

Spectral Code: 1H NMR : 400 MHz in CDCl3

       ppm   Int.  Assign.

      135.34   346      1
      131.50   537      2
      129.36   550      3
      129.02   854      4
      125.30   468      5
      125.13  1000      6
      124.59   984      7 *
      124.32   895      8 *
       31.65   412      9
       31.23   439     10
       29.90   414     11
       27.95   437     12
       22.57   351     13
       13.96   436     14

Spectral Code: 13C NMR : in CDCl3

Spectral Code: IR : nujol mull

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