KEGG   COMPOUND: C12288
Entry
C12288                      Compound                               
Name
alpha-Amylcinnamaldehyde;
alpha-Pentylcinnamaldehyde
Formula
C14H18O
Exact mass
202.1358
Mol weight
202.2921
Structure
Other DBs
CAS: 122-40-7
PubChem: 14432
ChEBI: 173562 32318
NIKKAJI: J9.183I
LinkDB
KCF data

ATOM        15
            1   C8y C    24.9900  -18.8300
            2   C8x C    24.9900  -20.2300
            3   C8x C    23.8000  -20.9300
            4   C8x C    22.5400  -20.2300
            5   C8x C    22.5400  -18.8300
            6   C8x C    23.8000  -18.1300
            7   C2b C    26.1800  -18.1300
            8   C2c C    27.4400  -18.8300
            9   C1b C    28.6300  -18.1300
            10  C1b C    29.8200  -18.8300
            11  C1b C    31.0100  -18.1300
            12  C1b C    32.2700  -18.8300
            13  C1a C    33.4600  -18.1300
            14  C4a C    27.4400  -20.2300
            15  O4a O    28.6300  -20.9300
BOND        15
            1     7   8 2
            2     2   3 2
            3     8   9 1
            4     3   4 1
            5     9  10 1
            6     4   5 2
            7    10  11 1
            8     5   6 1
            9    11  12 1
            10    6   1 2
            11   12  13 1
            12    8  14 1
            13    1   2 1
            14   14  15 2
            15    7   1 1

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