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3-cyclohexyl-2-oxidanylidene-propanal hydrate

3-cyclohexyl-2-oxidanylidene-propanal hydrate

Systemtic Name:3-cyclohexyl-2-oxidanylidene-propanal hydrate
Openeye Name:3-cyclohexyl-2-oxo-propanal hydrate
CAS Name:3-cyclohexyl-2-oxopropanal hydrate
IUPAC Name:3-cyclohexyl-2-oxopropanal hydrate
Traditional Name:3-cyclohexyl-2-keto-propionaldehyde hydrate
Formula: C9H16O3
MolecularWeight: 172.22154
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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(=O)C=O.O


Isomeric SMILES

C1CCC(CC1)CC(=O)C=O.O


InChI

InChI=1S/C9H14O2.H2O/c10-7-9(11)6-8-4-2-1-3-5-8;/h7-8H,1-6H2;1H2


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