KEGG   COMPOUND: C17665
Entry
C17665                      Compound                               
Name
2-Phenylpropyl acetate
Formula
C11H14O2
Exact mass
178.0994
Mol weight
178.2277
Structure
Other DBs
CAS: 10402-52-5
PubChem: 96024008
ChEBI: 81259
NIKKAJI: J34.547D
LinkDB
KCF data

ATOM        13
            1   C8x C    21.1400  -24.2200
            2   C8x C    21.1400  -25.6200
            3   C8x C    19.9500  -26.3200
            4   C8x C    18.6900  -25.6200
            5   C8x C    18.6900  -24.2200
            6   C8y C    19.9500  -23.5200
            7   C1c C    19.9672  -22.1201
            8   C1b C    21.1751  -21.4424
            9   C1a C    18.7508  -21.3976
            10  O7a O    22.3942  -22.1668
            11  C7a C    23.6098  -21.4854
            12  C1a C    24.8005  -22.1933
            13  O6a O    23.5574  -20.0905
BOND        13
            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     6   7 1
            8     7   8 1
            9     7   9 1
            10    8  10 1
            11   10  11 1
            12   11  12 1
            13   11  13 2

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