KEGG   COMPOUND: C13048
Entry
C13048                      Compound                               
Name
p-Nitrophenyl-O-ethyl ethylphosphonate;
Ethyl 4-nitrophenyl ethylphosphonate
Formula
C10H14NO5P
Exact mass
259.061
Mol weight
259.1956
Structure
Remark
Same as: D01591
Other DBs
CAS: 546-71-4
PubChem: 583437
ChEBI: 32353
NIKKAJI: J6.430K
LinkDB
KCF data

ATOM        17
            1   C8x C    20.2501  -14.6584
            2   C8y C    20.2501  -13.2572
            3   C8x C    19.0338  -12.5567
            4   C8x C    17.8246  -13.2572
            5   C8y C    17.8246  -14.6584
            6   C8x C    19.0338  -15.3589
            7   N2b N    21.4631  -12.5562 #+
            8   O3a O    22.6769  -13.2560
            9   O3a O    21.4624  -11.1550 #-
            10  O2b O    16.6106  -15.3581
            11  P1b P    15.4028  -14.6584
            12  O2b O    14.1927  -15.3520
            13  O3b O    16.6199  -13.9649
            14  C1b C    14.1927  -13.9578
            15  C1b C    12.9784  -14.6570
            16  C1a C    14.1944  -12.5567
            17  C1a C    11.7677  -15.3621
BOND        17
            1     2   3 1
            2     7   9 1
            3     3   4 2
            4     5  10 1
            5     4   5 1
            6    10  11 1
            7     5   6 2
            8    11  12 1
            9    12  15 1
            10    6   1 1
            11   11  13 2
            12   11  14 1
            13    2   7 1
            14    1   2 2
            15   14  16 1
            16    7   8 2
            17   15  17 1

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