943-29-3

trans-4-tert-Butylcyclohexanecarboxylic acid(943-29-3) ¹H NMR

Product Nametrans-4-tert-Butylcyclohexanecarboxylic acid

CAS 943-29-3

Molecular FormulaC11H20O2

Molecular Weight184.28

InChIInChI=1S/C11H20O2/c1-11(2,3)9-6-4-8(5-7-9)10(12)13/h8-9H,4-7H2,1-3H3,(H,12,13)/t8-,9-

InChIKey QVQKEGYITJBHRQ-KYZUINATSA-N

Smiles[C@@H]1(C(O)=O)CC[C@@H](C(C)(C)C)CC1

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trans-4-tert-Butylcyclohexanecarboxylic acid(943-29-3) <sup>1</sup>H NMR
Mass

MS2008-03734CW      
trans-4-tert-butylcyclohexanecarboxylic acid
C11H20O2            (Mass of molecular ion:    184)

   Source Temperature: 250 °C
   Sample Temperature:  25 °C
   Direct, 70 eV

      27.0       3.2
      29.0       7.4
      39.0       4.8
      41.0      23.3
      42.0       1.3
      43.0       4.4
      45.0       1.3
      53.0       3.4
      54.0       2.5
      55.0       8.4
      56.0      49.9
      57.0     100.0
      58.0       4.3
      67.0      10.4
      68.0       3.1
      69.0       4.2
      73.0       4.7
      77.0       1.9
      79.0       3.1
      80.0       3.6
      81.0      30.9
      82.0       3.4
      83.0       2.9
      93.0       1.8
      95.0       2.0
      99.0       1.9
     108.0       4.3
     109.0       9.5
     110.0       2.2
     111.0       1.0
     123.0      18.6
     124.0       1.9
     126.0       1.6
     127.0      39.3
     128.0      17.6
     129.0      56.7
     130.0       4.4
     151.0       5.5
     169.0       2.3