Marvin  03051214402D          

  7  7  0  0  0  0            999 V2000
   14.2097  -16.4269    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3847  -16.4269    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6222  -15.7124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9722  -15.7124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2097  -14.9979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3847  -14.9979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4472  -15.7124    0.0000 O   0  3  0  0  0  1  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  2  2  0  0  0  0
  5  3  1  0  0  0  0
  6  4  1  0  0  0  0
  6  5  2  0  0  0  0
  3  7  1  0  0  0  0
M  CHG  1   7   1
M  END
> <ID>
CHEBI:52245

> <NAME>
phenoxenium

> <STAR>
3

> <SYNONYM>
6-oxocyclohexa-2,4-dienylium; 4-oxocyclohexa-2,5-dienylium

> <IUPAC_NAME>
phenyloxidanylium

> <FORMULA>
C6H5O

> <MASS>
93.10330

> <MONOISOTOPIC_MASS>
93.03349

> <CHARGE>
1

> <SMILES>
[O+]c1ccccc1

> <INCHI>
InChI=1S/C6H5O/c7-6-4-2-1-3-5-6/h1-5H/q+1

> <INCHIKEY>
WNKVRTUXIGFGRT-UHFFFAOYSA-N

$$$$