Zingerone 3D structure

Zingerone (also called Vanillylacetone, Zingiberone) has the formula C11H14O3 and a molar mass of 194.23 g/mol. The model above is PubChem's computed 3D conformer: drag to rotate, scroll to zoom, and use the measurement tools to read bond lengths and angles.

Formula
C11H14O3
Molar mass
194.23 g/mol
PubChem CID
31211
Heavy atoms
14
Category
Food, flavor and fragrance

Explore in 3D Space-filling model PubChem

Identifiers

IUPAC name4-(4-hydroxy-3-methoxyphenyl)butan-2-one
SMILESCC(=O)CCC1=CC(=C(C=C1)O)OC
PubChem CID31211
Other namesVanillylacetone, Zingiberone, Zingherone, Gingerone, 4-Hydroxy-3-methoxybenzylacetone

How to read the 3D model

Atoms use the standard CPK colors: carbon gray, hydrogen white, oxygen red, nitrogen blue, sulfur yellow. Switch to Spacefill to see the molecule's overall shape and size, or Stick for a clear view of the bonds. Click two atoms in distance mode to measure a bond length in ångströms.

3D coordinates are PubChem's computed conformer, one low-energy shape of the molecule. Flexible molecules can take many other shapes.

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