552-63-6

DL-Tropic acid(552-63-6) IR2

Product NameDL-Tropic acid

CAS 552-63-6

Molecular FormulaC9H10O3

Molecular Weight166.18

InChIInChI=1S/C9H10O3/c10-6-8(9(11)12)7-4-2-1-3-5-7/h1-5,8,10H,6H2,(H,11,12)

InChIKey JACRWUWPXAESPB-UHFFFAOYSA-N

SmilesC(C1C=CC=CC=1)(CO)C(=O)O

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DL-Tropic acid(552-63-6) IR2
Mass

MS-NW-2013          
(+-)-3-hydroxy-2-phenylpropionic acid
C9H10O3             (Mass of molecular ion:    166)

   Source Temperature: 170 °C
   Sample Temperature: 120 °C
   Direct, 75 eV

      18.0       2.2
      27.0       2.0
      28.0       1.8
      29.0       2.4
      31.0       5.0
      38.0       1.4
      39.0       6.9
      41.0       1.3
      43.0       1.3
      44.0       1.0
      45.0       1.2
      50.0       2.8
      51.0       7.1
      52.0       1.5
      53.0       1.3
      62.0       1.7
      63.0       4.9
      64.0       1.5
      65.0       6.2
      77.0      13.6
      78.0       5.3
      79.0       9.2
      89.0       6.1
      90.0      23.2
      91.0      52.6
      92.0       6.7
      93.0       1.0
     102.0       1.1
     103.0      13.1
     104.0      31.8
     105.0       3.0
     107.0       3.0
     118.0      47.6
     119.0       5.2
     120.0       2.0
     121.0       2.2
     135.0       1.2
     136.0     100.0
     137.0       9.1
     148.0       1.6
     166.0       2.4