90291-46-6

N-(1-Naphthalenesulfonyl)-L-phenylalanine(90291-46-6) MS

Product NameN-(1-Naphthalenesulfonyl)-L-phenylalanine

Molecular FormulaC19H17NO4S

Molecular Weight355.41

InChIInChI=1S/C19H17NO4S/c21-19(22)17(13-14-7-2-1-3-8-14)20-25(23,24)18-12-6-10-15-9-4-5-11-16(15)18/h1-12,17,20H,13H2,(H,21,22)/t17-/m0/s1

InChIKey NWHURKYFYGKGRT-KRWDZBQOSA-N

SmilesC(O)(=O)[C@H](CC1=CC=CC=C1)NS(C1=C2C(C=CC=C2)=CC=C1)(=O)=O

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IR1

IR2

N-(1-Naphthalenesulfonyl)-L-phenylalanine(90291-46-6) MS
Mass

MS-IW-5655          
N-(1-naphthylsulfonyl)-L-phenylalanyl chloride
C19H16ClNO3S        (Mass of molecular ion:    373)

   Source Temperature: 180 °C
   Sample Temperature: 170 °C
   Direct, 75 eV

      28.0      12.2
      35.0       1.1
      36.0      14.7
      38.0       4.8
      39.0       2.1
      51.0       2.9
      63.0       2.4
      64.0       1.4
      65.0       5.9
      74.0       1.0
      75.0       2.5
      76.0       1.4
      77.0       6.6
      89.0       3.7
      90.0       4.2
      91.0      54.2
      92.0       4.8
     101.0       3.8
     102.0       1.3
     115.0       3.9
     116.0       3.0
     117.0      19.1
     118.0     100.0
     119.0      10.2
     126.0       7.1
     127.0      85.9
     128.0      17.2
     129.0       1.5
     143.0       4.5
     144.0       1.1
     154.0       1.0
     160.0       4.3
     168.0       1.2
     175.0       2.1
     176.0       1.2
     191.0      21.9
     192.0       3.1
     193.0       1.3
     202.0       2.2
     203.0       1.6
     207.0       2.5
     215.0       2.4
     216.0       1.3
     217.0       5.7
     218.0       6.6
     219.0       1.4
     243.0       1.0
     244.0       2.8
     245.0       7.9
     246.0       1.6
     309.0      44.5
     310.0      18.1
     311.0       4.9
     312.0       1.1

KBr disc

nujol mull

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