609-23-4

2,4,6-Triiodophenol(609-23-4) IR2

Product Name2,4,6-Triiodophenol

CAS 609-23-4

Molecular FormulaC6H3I3O

Molecular Weight471.8

InChIInChI=1S/C6H3I3O/c7-3-1-4(8)6(10)5(9)2-3/h1-2,10H

InChIKey VAPDZNUFNKUROY-UHFFFAOYSA-N

SmilesC1(O)=C(I)C=C(I)C=C1I

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2,4,6-Triiodophenol(609-23-4) IR2
Mass

MS-NW-0280          
2,4,6-triiodophenol
C6H3I3O             (Mass of molecular ion:    472)

   Source Temperature: 160 °C
   Sample Temperature:   0 °C
   Direct, 75 eV

      37.0       1.8
      53.0       1.8
      61.0       5.6
      62.0      12.1
      63.0       9.3
      90.0       2.5
      91.0       8.5
     127.0       3.2
     128.0       1.6
     189.0       5.4
     190.0       1.7
     217.0       1.4
     218.0      15.6
     219.0       1.1
     236.0       3.6
     317.0       2.2
     344.0       1.5
     345.0       5.8
     472.0     100.0
     473.0       6.8

parameter in DMSO-d6

2,4,6-Triiodophenol(609-23-4) IR2

¹H NMR	300 MHz
C₆ H₃ I₃ O	0.041 g : 0.5 ml DMSO-d6
2,4,6-triiodophenol

    Parameter     ppm  Hz

      D(A)         7.989
     
      D(B)         9.74

     Hz     ppm     Int.

   2922.00   9.740     24
   2396.70   7.989   1000

DMSO-d6

CCl4 solution

KBr disc

nujol mull

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