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Back ChemicalBook Home>CAS DataBase List>627-77-0More Spectrum> DL-CITRULLINE(627-77-0) IR2

627-77-0

DL-CITRULLINE(627-77-0) IR2

Product NameDL-CITRULLINE

CAS627-77-0

Molecular FormulaC6H13N3O3

Molecular Weight175.19

InChIInChI=1S/C6H13N3O3/c7-4(5(10)11)2-1-3-9-6(8)12/h4H,1-3,7H2,(H,10,11)(H3,8,9,12)/t4-/m0/s1

InChIKey RHGKLRLOHDJJDR-BYPYZUCNSA-N

SmilesC(O)(=O)[C@H](CCCNC(N)=O)N

  • DL-CITRULLINE(627-77-0) IR2
    Mass

    MS-NW-1922          
    DL-2-amino-5-ureidovaleric acid
    C6H13N3O3           (Mass of molecular ion:    175)
    

       Source Temperature: 220 °C
       Sample Temperature: 250 °C
       Direct, 75 eV
    

          12.0       1.1
          14.0       1.0
          15.0       4.7
          16.0       9.8
          17.0      13.8
          18.0      26.2
          26.0       4.1
          27.0      12.6
          28.0      46.0
          29.0      11.5
          30.0      57.1
          31.0       2.8
          32.0       1.5
          37.0       1.2
          38.0       2.9
          39.0      12.9
          40.0       5.8
          41.0      33.9
          42.0      23.2
          43.0      66.4
          44.0      39.7
          45.0       2.5
          51.0       1.7
          52.0       3.1
          53.0       3.0
          54.0       8.6
          55.0       7.4
          56.0      63.9
          57.0      15.3
          58.0      31.4
          59.0       2.0
          66.0       1.6
          67.0       3.8
          68.0      14.2
          69.0     100.0
          70.0      38.7
          71.0       2.7
          74.0       1.7
          75.0       2.8
          80.0       1.2
          81.0       1.0
          82.0       3.0
          83.0       3.0
          84.0       2.9
          85.0       7.1
          86.0       6.2
          87.0       2.1
          93.0       1.0
          94.0       1.4
          95.0       2.5
          96.0       2.8
          97.0       8.1
          98.0       1.7
          99.0       1.3
         101.0       1.4
         103.0       1.1
         110.0       1.7
         111.0       2.9
         112.0       5.1
         113.0       5.4
         114.0       5.8
         115.0       1.2
         135.0       1.6
         136.0       1.3
         137.0       1.6
         138.0       2.0
         139.0       1.9
         140.0       3.8
         164.0       1.3
         176.0       1.1
         190.0       1.3
         197.0       1.1
    

KBr disc

  • DL-CITRULLINE(627-77-0) IR2

nujol mull

  • DL-CITRULLINE(627-77-0) IR2

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