Ethyl (S)-3-hydroxybutyrate(56816-01-4) MS

Product NameEthyl (S)-3-hydroxybutyrate

CAS 56816-01-4

Molecular FormulaC6H12O3

Molecular Weight132.16

InChIInChI=1S/C6H12O3/c1-3-9-6(8)4-5(2)7/h5,7H,3-4H2,1-2H3/t5-/m0/s1

InChIKey OMSUIQOIVADKIM-YFKPBYRVSA-N

SmilesC(OCC)(=O)C[C@@H](O)C

Request For Quotation

¹HNMR

IR1

Raman

Mass

MS2001-00809WA      
(S)-(+)-3-hydroxy-butyric acid ethyl ester
C6H12O3             (Mass of molecular ion:    132)

   Source Temperature: 300 °C
   Sample Temperature: 260 °C
   Reservoir, 70 eV

      14.0       4.1
      15.0       8.2
      18.0       2.9
      19.0       1.5
      25.0       1.3
      26.0       5.0
      27.0      16.7
      28.0       6.5
      29.0      26.8
      30.0       1.6
      31.0      21.5
      38.0       1.3
      39.0       9.8
      40.0       1.6
      41.0      13.6
      42.0      29.3
      43.0     100.0
      44.0      19.6
      45.0      59.8
      46.0       4.9
      47.0       1.6
      55.0       1.1
      58.0       2.9
      60.0      22.3
      61.0      16.3
      68.0       2.9
      69.0      39.6
      70.0      11.9
      71.0      21.7
      73.0       3.8
      75.0       3.4
      85.0       6.6
      86.0       5.9
      87.0      25.8
      88.0      26.0
      89.0       7.2
      91.0       1.3
      99.0      11.9
     103.0       2.2
     114.0       2.6
     117.0      16.0