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nonan-3-one hydrate hydrochloride

nonan-3-one hydrate hydrochloride

Systemtic Name:nonan-3-one hydrate hydrochloride
Openeye Name:nonan-3-one hydrate hydrochloride
CAS Name:3-nonanone hydrate hydrochloride
IUPAC Name:nonan-3-one hydrate hydrochloride
Traditional Name:nonan-3-one hydrate hydrochloride
Formula: C9H21ClO2
MolecularWeight: 196.71484
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)CC.O.Cl


Isomeric SMILES

CCCCCCC(=O)CC.O.Cl


InChI

InChI=1S/C9H18O.ClH.H2O/c1-3-5-6-7-8-9(10)4-2;;/h3-8H2,1-2H3;1H;1H2


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