KEGG   COMPOUND: C15045
Entry
C15045                      Compound                               
Name
4-Chloro-[2-(4-Pyridinyl)-1-butenyl]phenol;
4-[1-[(4-Chlorophenyl)methylene]propyl]pyridine
Formula
C15H14ClN
Exact mass
243.0815
Mol weight
243.7314
Structure
Other DBs
PubChem: 17396042
ChEBI: 79565
NIKKAJI: J2.791.768B
LinkDB
KCF data

ATOM        17
            1   C8x C    16.8279  -17.1235
            2   N5x N    16.8279  -18.5272
            3   C8x C    18.0434  -19.2289
            4   C8x C    19.2590  -18.5272
            5   C8y C    19.2590  -17.1235
            6   C8x C    18.0434  -16.4217
            7   C2c C    20.4933  -16.4107
            8   C2b C    21.7016  -17.1082
            9   C8y C    22.8870  -16.4236
            10  C8x C    24.0840  -17.1147
            11  C8x C    25.2995  -16.4129
            12  C8y C    25.2995  -15.0093
            13  C8x C    24.1025  -14.3182
            14  C8x C    22.8870  -15.0201
            15  C1b C    20.4930  -15.0183
            16  C1a C    19.2655  -14.3097
            17  X   Cl   26.5019  -14.3148
BOND        18
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     5   7 1
            8     7   8 2
            9     8   9 1
            10    9  10 2
            11   10  11 1
            12   11  12 2
            13   12  13 1
            14   13  14 2
            15    9  14 1
            16    7  15 1
            17   15  16 1
            18   12  17 1

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