KEGG   COMPOUND: C14287
Entry
C14287                      Compound                               
Name
4,4'-Methylenebis(2,6-di-tert-butylphenol)
Formula
C29H44O2
Exact mass
424.3341
Mol weight
424.6585
Structure
Other DBs
CAS: 118-82-1
PubChem: 17395287
ChEBI: 34369
NIKKAJI: J39.600A
LinkDB
KCF data

ATOM        31
            1   C8x C    26.8748  -20.1462
            2   C8x C    25.6907  -18.1082
            3   C8x C    30.4047  -18.0952
            4   C8x C    29.2318  -20.1397
            5   C1b C    28.0476  -18.1018
            6   C8y C    26.8710  -18.7854
            7   C8y C    29.2280  -18.7789
            8   C8y C    25.6982  -20.8298
            9   C8y C    24.5141  -18.7919
            10  C8y C    31.5851  -18.7724
            11  C8y C    30.4121  -20.8169
            12  C8y C    24.5178  -20.1527
            13  C8y C    31.5888  -20.1332
            14  O1a O    23.3412  -20.8364
            15  O1a O    32.7692  -20.8104
            16  C1d C    32.7573  -18.0911
            17  C1d C    30.3457  -22.1485
            18  C1d C    25.7017  -22.2165
            19  C1d C    23.3246  -18.1092
            20  C1a C    33.9504  -18.7759
            21  C1a C    32.7510  -16.2294
            22  C1a C    33.9688  -17.3873
            23  C1a C    22.1426  -18.7957
            24  C1a C    23.3213  -16.2970
            25  C1a C    22.1750  -17.4537
            26  C1a C    24.5335  -22.8949
            27  C1a C    30.3457  -23.6185
            28  C1a C    29.2158  -23.0685
            29  C1a C    31.6982  -22.8485
            30  C1a C    25.7017  -23.8965
            31  C1a C    27.0541  -23.0565
BOND        32
            1     1   6 2
            2     1   8 1
            3     2   6 1
            4     2   9 2
            5     3   7 2
            6     3  10 1
            7     4   7 1
            8     4  11 2
            9     5   6 1
            10    5   7 1
            11    8  12 2
            12    9  12 1
            13   10  13 2
            14   11  13 1
            15   12  14 1
            16   13  15 1
            17   10  16 1
            18   11  17 1
            19    8  18 1
            20    9  19 1
            21   16  20 1
            22   16  21 1
            23   16  22 1
            24   19  23 1
            25   19  24 1
            26   19  25 1
            27   18  26 1
            28   17  27 1
            29   17  28 1
            30   17  29 1
            31   18  30 1
            32   18  31 1

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