1'-HYDROXY-2'-ACETONAPHTHONE(711-79-5) ¹³C NMR

Product Name1'-HYDROXY-2'-ACETONAPHTHONE

CAS 711-79-5

Molecular FormulaC12H10O2

Molecular Weight186.21

InChIInChI=1S/C12H10O2/c1-8(13)10-7-6-9-4-2-3-5-11(9)12(10)14/h2-7,14H,1H3

InChIKey JBGJVMVWYWUVOW-UHFFFAOYSA-N

SmilesC(=O)(C1=CC=C2C(=C1O)C=CC=C2)C

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Mass

MS-KW-0194          
1'-hydroxy-2'-acetonaphthone
C12H10O2            (Mass of molecular ion:    186)

   Source Temperature: 230 °C
   Sample Temperature: 150 °C
   Reservoir, 75 eV

      28.0       1.4
      39.0       2.2
      43.0       6.3
      50.0       1.2
      51.0       2.5
      57.0       1.6
      57.5       5.5
      62.0       1.9
      63.0       5.0
      64.0       1.8
      65.0       2.3
      70.0       1.5
      71.0       3.2
      71.5       1.4
      74.0       1.3
      75.0       1.7
      77.0       1.3
      85.5       4.4
      86.0       1.5
      87.0       1.5
      88.0       2.1
      89.0       4.3
      93.0       4.1
     113.0       2.5
     114.0       5.8
     115.0      26.2
     116.0       3.0
     127.0       1.4
     128.0       2.2
     129.0       1.3
     139.0       3.8
     140.0       2.9
     143.0      15.2
     144.0       2.3
     168.0      10.8
     169.0       1.5
     171.0     100.0
     172.0      12.2
     173.0       1.1
     186.0      67.4
     187.0       9.0

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₁₂ H₁₀ O₂	0.039 g : 0.5 ml CDCl₃
1'-hydroxy-2'-acetonaphthone

    Assign.     Shift(ppm)

      A            14.0
      B             8.430
      C             7.714
      D             7.593
      E             7.571
      F             7.497
      G             7.212
      J             2.641

     Hz     ppm     Int.

   5596.17  14.003    503
   3374.71   8.445     38
   3374.07   8.443     70
   3373.43   8.441     68
   3372.79   8.440     69
   3371.93   8.438     42
   3366.38   8.424     40
   3365.74   8.422     72
   3365.10   8.421     71
   3364.46   8.419     69
   3363.60   8.417     43
   3087.95   7.727     62
   3087.31   7.726     55
   3079.83   7.707     84
   3079.19   7.705     73
   3042.86   7.614     62
   3041.58   7.611     63
   3036.02   7.597     86
   3034.74   7.594    113
   3033.46   7.591     50
   3030.47   7.583    150
   3027.90   7.577     65
   3026.41   7.573     65
   3021.71   7.561    170
   3003.97   7.517     61
   3002.69   7.514     61
   2997.13   7.500     47
   2995.85   7.497     89
   2994.35   7.493     60
   2988.80   7.479     42
   2987.52   7.476     41
   2886.44   7.223    101
   2877.90   7.202     89
   2877.47   7.200     88
   1058.38   2.649     45
   1055.60   2.642   1000

in CDCl3