KEGG   COMPOUND: C14311
Entry
C14311                      Compound                               
Name
4-Propylphenol
Formula
C9H12O
Exact mass
136.0888
Mol weight
136.191
Structure
Other DBs
CAS: 645-56-7
PubChem: 17395311
ChEBI: 34434
NIKKAJI: J13.769C
LinkDB
KCF data

ATOM        10
            1   C1a C    31.6705  -18.1308
            2   C8x C    26.8424  -18.1268
            3   C8x C    28.0477  -20.2184
            4   C8x C    25.6351  -18.8227
            5   C8x C    26.8402  -20.9143
            6   C1b C    30.4629  -18.8266
            7   C1b C    29.2564  -18.1288
            8   C8y C    28.0488  -18.8247
            9   C8y C    25.6337  -20.2163
            10  O1a O    24.4261  -20.9122
BOND        10
            1     1   6 1
            2     2   4 2
            3     2   8 1
            4     3   5 1
            5     3   8 2
            6     4   9 1
            7     5   9 2
            8     6   7 1
            9     7   8 1
            10    9  10 1

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