Marvin  11231213212D          

 16 17  0  0  0  0            999 V2000
   -1.4735   -0.5856    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4735   -1.4106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1880   -1.8231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9025   -1.4106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9025   -0.5856    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1880   -0.1731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7591   -0.1731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3842   -0.5856    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3842   -1.4106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6698   -0.1731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6698    0.6519    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0987   -0.1731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0987   -1.8231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8132   -0.5856    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8132   -1.4106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0447   -0.5856    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  6  1  2  0  0  0  0
  1  7  1  0  0  0  0
  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  3  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  7 16  1  0  0  0  0
 12  8  1  0  0  0  0
  9  8  2  0  0  0  0
  8 10  1  0  0  0  0
 13  9  1  0  0  0  0
 11 10  2  0  0  0  0
 10 16  1  0  0  0  0
 14 12  2  0  0  0  0
 15 13  2  0  0  0  0
 15 14  1  0  0  0  0
M  END
> <ID>
CHEBI:71231

> <NAME>
dihydrochalcone

> <DEFINITION>
A member of the class of dihydrochalcones that is acetophenone in which one of the hydrogens of the methyl group is replaced by a benzyl group.

> <STAR>
3

> <SYNONYM>
Hydrocinnamophenone; Hydrochalcone; beta-phenylpropiophenone; benzyl acetophenone; 1,3-Diphenyl-1-oxopropane

> <IUPAC_NAME>
1,3-diphenylpropan-1-one

> <FORMULA>
C15H14O

> <MASS>
210.27110

> <MONOISOTOPIC_MASS>
210.10447

> <CHARGE>
0

> <SMILES>
O=C(CCc1ccccc1)c1ccccc1

> <INCHI>
InChI=1S/C15H14O/c16-15(14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h1-10H,11-12H2

> <INCHIKEY>
QGGZBXOADPVUPN-UHFFFAOYSA-N

> <CAS_REGISTRY_NUMBER>
1083-30-3

> <REAXYS_REGISTRY_NUMBER>
1910661

> <CHEMIDPLUS>
1083-30-3

> <WIKIPEDIA_ACCESSION>
Dihydrochalcone

$$$$