KEGG   COMPOUND: C06747Help
Entry
C06747                      Compound                               

Name
Phenylmethanesulfonyl fluoride;
Benzenemethanesulfonyl fluoride;
PMSF
Formula
C7H7FO2S
Exact mass
174.0151
Mol weight
174.1927
Structure
Mol fileKCF fileDB search
Other DBs
CAS: 329-98-6
PubChem: 8968
ChEBI: 8102
ChEMBL: CHEMBL190503
NIKKAJI: J150.773G
KCF data Show

ATOM        11
            1   C8y C    28.6309  -19.5192
            2   C1b C    27.4210  -20.2205
            3   C8x C    28.6309  -18.1222
            4   C8x C    29.8465  -20.2205
            5   S4a S    26.2112  -19.5192
            6   C8x C    29.8465  -17.4208
            7   C8x C    31.0505  -19.5192
            8   C8x C    31.0505  -18.1222
            9   X   F    24.9695  -20.2334
            10  O3c O    27.2711  -18.5293
            11  O3c O    24.9988  -18.6792
BOND        11
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 1
            5     3   6 1
            6     4   7 2
            7     6   8 2
            8     7   8 1
            9     5   9 1
            10    5  10 2
            11    5  11 2

» Japanese version

DBGET integrated database retrieval system