3,4,5-三甲氧基芐醇(3840-31-1)質(zhì)譜(MS)

產(chǎn)品名稱:3,4,5-三甲氧基芐醇

CAS:3840-31-1

分子式:C10H14O4

分子量: 198.22

InChI:InChI=1S/C10H14O4/c1-12-8-4-7(6-11)5-9(13-2)10(8)14-3/h4-5,11H,6H2,1-3H3

InChIKey: QPHLRCUCFDXGLY-UHFFFAOYSA-N

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

Mass

MS-NW-6103          
3,4,5-trimethoxybenzyl alcohol
C10H14O4            (Mass of molecular ion:    198)

   Source Temperature: 260 °C
   Sample Temperature: 190 °C
   Reservoir, 75 eV

      15.0       5.9
      18.0       1.7
      27.0       3.8
      28.0       4.0
      29.0       3.4
      31.0       2.8
      38.0       2.5
      39.0       8.5
      40.0       1.2
      41.0       6.6
      43.0       2.0
      45.0       2.2
      50.0       2.8
      51.0       4.6
      52.0       3.3
      53.0       6.6
      55.0       3.4
      57.0       2.0
      59.0       2.0
      62.0       1.2
      63.0       2.1
      64.0       1.2
      65.0       4.4
      66.0       3.4
      67.0       4.0
      68.0       1.9
      69.0       3.5
      71.0       1.0
      77.0       6.3
      78.0       1.8
      79.0       2.7
      80.0       2.1
      81.0       6.3
      82.0       1.9
      83.0       3.0
      89.0       1.5
      92.0       1.1
      93.0       4.1
      94.0       1.8
      95.0      16.5
      96.0       2.7
      97.0       4.8
     105.0       1.4
     107.0       2.1
     108.0       2.8
     109.0       3.2
     110.0       2.2
     111.0       4.5
     112.0       2.3
     121.0       1.5
     122.0       1.4
     123.0      13.0
     124.0       4.1
     125.0       4.5
     126.0       1.5
     127.0      27.8
     128.0       2.4
     135.0       1.1
     136.0       1.9
     137.0       3.3
     138.0       4.2
     139.0       3.8
     140.0       5.1
     148.0       1.7
     151.0       4.6
     152.0       2.1
     153.0       1.4
     154.0       2.7
     155.0       9.5
     165.0       1.1
     167.0       4.0
     169.0       4.8
     181.0       7.4
     182.0       2.6
     183.0      18.4
     184.0       2.1
     196.0       3.2
     197.0       2.0
     198.0     100.0
     199.0      11.2
     200.0       1.6

90 MHz in CDCl3

¹H NMR	89.56 MHz
C₁₀ H₁₄ O₄	0.04 ml : 0.5 ml CDCl₃
3,4,5-trimethoxybenzyl alcohol

    Assign.     Shift(ppm)

      A             6.549
      B             4.55
      C             3.794
      D             3.6

     Hz     ppm     Int.

    586.63   6.551    182
    407.38   4.549     65
    339.81   3.795   1000

in CDCl3

liquid film

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