4412-91-3

3-呋喃甲醇(4412-91-3)Raman光谱

产品名称:3-呋喃甲醇

CAS:4412-91-3

分子式:C5H6O2

分子量: 98.1

InChI:InChI=1S/C5H6O2/c6-3-5-1-2-7-4-5/h1-2,4,6H,3H2

InChIKey: STJIISDMSMJQQK-UHFFFAOYSA-N

Smiles:O1C=CC(CO)=C1

Mass

MS-IW-1326          
3-furanmethanol
C5H6O2              (Mass of molecular ion:     98)

   Source Temperature: 240 °C
   Sample Temperature: 160 °C
   Reservoir, 75 eV

      15.0       1.2
      26.0       2.3
      27.0       9.7
      28.0       2.8
      29.0      12.3
      31.0       8.1
      37.0       3.8
      38.0       6.9
      39.0      31.7
      40.0       4.6
      41.0      53.3
      42.0      25.2
      43.0       5.7
      44.0       3.7
      48.5       3.2
      49.0       1.4
      50.0       5.8
      51.0      10.3
      52.0       6.5
      53.0      20.3
      54.0       1.7
      55.0       9.0
      66.0       1.1
      67.0       3.1
      68.0       1.9
      69.0      42.6
      70.0      23.0
      71.0       3.8
      79.0       1.8
      81.0      29.6
      82.0       2.7
      95.0       8.8
      96.0       2.7
      97.0      47.6
      98.0     100.0
      99.0       5.9

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₅ H₆ O₂	0.05 ml : 0.5 ml CDCl₃
3-furanmethanol

    Assign.     Shift(ppm)

      A             7.358
      B             7.348
      C             6.375
      D             4.430
      E             3.44

     Hz     ppm     Int.

   2942.63   7.364    278
   2941.04   7.360    581
   2939.21   7.355    478
   2938.35   7.353    256
   2937.50   7.351    524
   2936.65   7.349    557
   2935.91   7.347    453
   2935.06   7.345    350
   2934.33   7.343    169
   2549.56   6.380    384
   2548.58   6.378    429
   2548.10   6.376    372
   2547.73   6.375    407
   2547.12   6.374    374
   2546.75   6.373    416
   1771.00   4.432    975
   1770.51   4.431    985
   1770.14   4.430   1000
   1375.61   3.443     56

in CDCl3