對甲氧基苯甲醛(123-11-5)Raman光譜

產(chǎn)品名稱:對甲氧基苯甲醛

CAS:123-11-5

分子式:C8H8O2

分子量: 136.15

InChI:InChI=1S/C8H8O2/c1-10-8-4-2-7(6-9)3-5-8/h2-6H,1H3

InChIKey: ZRSNZINYAWTAHE-UHFFFAOYSA-N

Smiles:C(=O)C1=CC=C(OC)C=C1

Mass

MS-NW-8483          
p-anisaldehyde
C8H8O2              (Mass of molecular ion:    136)

   Source Temperature: 260 °C
   Sample Temperature: 140 °C
   Reservoir, 75 eV

      15.0       1.3
      27.0       1.6
      28.0       1.7
      29.0       2.6
      37.0       1.8
      38.0       5.6
      39.0      13.0
      50.0       8.7
      51.0      10.0
      52.0       1.3
      53.0       2.0
      61.0       1.4
      62.0       3.8
      63.0      11.9
      64.0      11.6
      65.0      12.6
      66.0       1.4
      74.0       3.9
      75.0       2.5
      76.0       3.7
      77.0      38.1
      78.0       5.1
      79.0       3.7
      92.0      20.1
      93.0       3.0
     105.0       1.3
     107.0      19.0
     108.0       2.6
     135.0     100.0
     136.0      75.0
     137.0       6.8

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₈ H₈ O₂	0.05 ml : 0.5 ml CDCl₃
p-anisaldehyde

    Assign.     Shift(ppm)

      A             9.861
      B             7.816
      C             6.984
      D             3.856

     Hz     ppm     Int.

   3941.04   9.862    412
   3130.95   7.835     67
   3128.36   7.828    374
   3126.37   7.823    136
   3121.49   7.811    144
   3119.51   7.806    381
   3116.91   7.800     63
   2798.16   7.002     62
   2795.56   6.996    333
   2793.73   6.991    121
   2788.70   6.978    122
   2786.87   6.974    312
   2784.12   6.967     50
   1541.14   3.857   1000

in CDCl3