2-氯乙氧基-2-乙氧基二乙醇(5197-62-6)紅外圖譜(IR1)

產(chǎn)品名稱:2-氯乙氧基-2-乙氧基二乙醇

CAS:5197-62-6

分子式:C6H13ClO3

分子量: 168.62

InChI:InChI=1S/C6H13ClO3/c7-1-3-9-5-6-10-4-2-8/h8H,1-6H2

InChIKey: KECMLGZOQMJIBM-UHFFFAOYSA-N

Smiles:C(O)COCCOCCCl

Mass

MS-IW-0913          
2-(2-(2-chloroethoxy)ethoxy)ethanol
C6H13ClO3           (Mass of molecular ion:    168)

   Source Temperature: 220 °C
   Sample Temperature: 150 °C
   Reservoir, 75 eV

      15.0       1.4
      19.0       2.7
      27.0      16.0
      28.0       6.6
      29.0       3.5
      31.0       8.5
      43.0      11.7
      44.0      12.1
      45.0     100.0
      46.0       3.2
      57.0       1.2
      58.0      24.1
      59.0      15.5
      62.0       1.6
      63.0      57.0
      64.0       1.7
      65.0      18.1
      72.0       1.0
      73.0       3.9
      75.0      33.4
      76.0       1.3
      87.0       5.3
      88.0       3.7
      89.0      18.2
      93.0       7.8
      95.0       2.6
     101.0       3.1
     102.0       2.5
     106.0       6.2
     107.0      26.5
     108.0       3.2
     109.0       8.5
     137.0       7.2
     139.0       2.3

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₆ H₁₃ Cl O₃	0.05 ml : 0.5 ml CDCl₃
2-(2-(2-chloroethoxy)ethoxy)ethanol

    Assign.     Shift(ppm)

      A             3.766
      B             3.730
      C             3.69
      D             3.653
      E             3.612
      F             3.09
     
     ASSIGNED BY C-H COSY

     Hz     ppm     Int.

   1512.21   3.784    226
   1511.47   3.782    227
   1506.47   3.770    453
   1505.49   3.768    295
   1500.61   3.755    372
   1500.12   3.754    358
   1495.97   3.744    239
   1493.65   3.738    116
   1491.70   3.733    311
   1490.11   3.729    190
   1488.53   3.725    118
   1486.69   3.720    335
   1483.52   3.713     56
   1482.30   3.709     46
   1480.10   3.704    100
   1478.88   3.701    153
   1478.03   3.699    174
   1474.00   3.689   1000
   1469.48   3.677    160
   1467.41   3.672    113
   1465.33   3.667    380
   1464.84   3.666    381
   1459.96   3.654    299
   1459.23   3.652    437
   1456.30   3.644     49
   1455.20   3.642     54
   1453.86   3.638    230
   1453.13   3.637    228
   1447.88   3.623    399
   1446.04   3.619    113
   1444.46   3.615    194
   1442.99   3.611    325
   1440.92   3.606    102
   1438.60   3.600    251
   1234.50   3.089     57

in CDCl3