Product Name1,4,5,8-Tetrakis[(acetylthio)methyl]naphthalene

CAS

Molecular FormulaC22H24O4S4

Molecular Weight480.68356

InChIInChI=1S/C22H24O4S4/c1-13(23)27-9-17-5-6-19(11-29-15(3)25)22-20(12-30-16(4)26)8-7-18(21(17)22)10-28-14(2)24/h5-8H,9-12H2,1-4H3

InChIKey QRKCVZMJFUSQQM-UHFFFAOYSA-N

SmilesC1(CSC(C)=O)=C2C(C(CSC(C)=O)=CC=C2CSC(C)=O)=C(CSC(C)=O)C=C1

Request For Quotation

¹HNMR

¹³CNMR

Mass

MS-IW-2035          
1,4,5,8-tetrakis((acetylthio)methyl)naphthalene
C22H24O4S4          (Mass of molecular ion:    480)

   Source Temperature: 210 °C
   Sample Temperature: 220 °C
   Direct, 75 eV

      14.0       2.0
      15.0       9.8
      28.0       1.3
      32.0       1.5
      33.0       1.2
      41.0       1.1
      42.0       4.2
      43.0      95.4
      44.0       2.6
      45.0       5.3
      59.0       1.4
      60.0       1.7
      61.0       1.5
      63.0       1.5
      75.0       1.1
      89.0       1.2
     104.0       1.8
     115.0       1.6
     126.0       1.1
     127.0       1.0
     139.0       3.4
     150.0       2.6
     151.0       6.2
     152.0      11.3
     153.0       6.3
     154.0       1.4
     155.0       2.7
     163.0       5.0
     164.0       4.7
     165.0      36.8
     166.0      11.1
     167.0       6.9
     168.0       1.4
     169.0       1.1
     170.0       1.7
     171.0       3.8
     172.0       1.1
     176.0      14.7
     177.0      19.5
     178.0      10.9
     179.0       9.5
     180.0       2.4
     183.0       1.3
     184.0      10.0
     185.0      28.3
     186.0       5.1
     187.0       2.1
     195.0      13.7
     196.0      12.1
     197.0      22.3
     198.0      25.0
     199.0     100.0
     200.0      16.1
     201.0       5.7
     207.0       1.3
     208.0      16.9
     209.0      26.9
     210.0      35.8
     211.0      33.8
     212.0      10.6
     213.0       7.8
     214.0       5.0
     215.0       5.1
     216.0       3.1
     217.0       1.3
     226.0       1.2
     227.0      10.5
     228.0       6.9
     229.0      22.8
     230.0       9.6
     231.0      28.3
     232.0       5.4
     233.0       2.9
     237.0       2.2
     239.0       1.2
     240.0       1.4
     241.0       3.9
     242.0       6.2
     243.0      88.9
     244.0      33.4
     245.0      75.6
     246.0      14.2
     247.0       7.2
     248.0       1.1
     252.0       2.5
     253.0       2.7
     269.0       1.7
     271.0       1.7
     273.0      14.2
     274.0       2.8
     275.0       1.9
     277.0       2.2
     285.0       4.2
     286.0       3.1
     287.0      10.0
     288.0       3.4
     289.0       1.2
     311.0      45.5
     312.0      10.2
     313.0       5.3
     314.0       1.0
     319.0       2.5
     329.0       1.8
     330.0       1.9
     348.0       1.6
     361.0       9.5
     362.0      17.8
     363.0       4.9
     364.0       2.7
     480.0       8.4
     481.0       2.1
     482.0       1.6

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₂₂ H₂₄ O₄ S₄	0.010 g : 0.5 ml CDCl₃
1,4,5,8-tetrakis((acetylthio)methyl)naphthalene

    Assign.     Shift(ppm)

      A             7.453
      B             4.604
      C             2.343

     Hz     ppm     Int.

   2978.88   7.454    333
   1840.21   4.605    424
    936.40   2.344   1000

in CDCl3

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