51630-58-1

氰戊菊酯(51630-58-1)核磁图(¹³CNMR)

分子式:C25H22ClNO3

分子量: 419.9

InChI:InChI=1S/C25H22ClNO3/c1-17(2)24(18-11-13-20(26)14-12-18)25(28)30-23(16-27)19-7-6-10-22(15-19)29-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3

InChIKey: NYPJDWWKZLNGGM-UHFFFAOYSA-N

Smiles:C1(=CC=C(Cl)C=C1)C(C(C)C)C(=O)OC(C#N)C1=CC=CC(OC2C=CC=CC=2)=C1

¹³CNMR

IR1

Mass

MS2001-00695WA      
fenvalerate
C25H22ClNO3         (Mass of molecular ion:    419)

   Source Temperature: 200 °C
   Sample Temperature:  20 °C
   Direct, 70 eV

      27.0       3.5
      29.0       1.7
      39.0       4.5
      41.0       7.1
      43.0      26.1
      50.0       1.9
      51.0       7.7
      55.0       9.6
      62.0       1.1
      63.0       3.2
      64.0       1.5
      65.0       3.5
      75.0       2.1
      76.0       2.9
      77.0      19.2
      78.0       2.3
      88.0       2.6
      89.0      10.0
      90.0       2.9
      91.0       4.6
      99.0       1.0
     101.0       1.3
     102.0       1.9
     103.0       5.0
     104.0       1.3
     113.0       1.6
     114.0       4.3
     115.0      21.6
     116.0       8.8
     117.0      10.7
     118.0       1.2
     124.0       4.4
     125.0      76.5
     126.0       7.4
     127.0      25.3
     128.0       3.6
     129.0       1.8
     130.0       1.3
     131.0       1.7
     139.0       9.6
     140.0       2.8
     141.0       9.4
     142.0       1.4
     143.0       1.1
     149.0       1.6
     150.0       1.2
     151.0       4.9
     152.0      32.3
     153.0       9.7
     154.0       9.1
     155.0       1.2
     165.0       1.7
     166.0       1.4
     167.0     100.0
     168.0      16.0
     169.0      41.4
     170.0       6.4
     171.0       3.3
     177.0       1.3
     178.0       3.2
     179.0       2.3
     180.0      13.4
     181.0      61.4
     182.0       9.1
     183.0       1.2
     190.0       1.8
     197.0       5.5
     198.0       5.4
     199.0       1.0
     206.0       6.3
     207.0       5.8
     208.0      20.4
     209.0      11.7
     210.0       2.2
     223.0       1.6
     224.0       2.0
     225.0      29.3
     226.0       5.1
     293.0       2.7
     295.0       1.0
     331.0       1.3
     419.0      68.2
     420.0      18.8
     421.0      24.4
     422.0       6.4
     423.0       1.0

in CDCl3